Viewing Compound With Structures

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Compound Report Overview

Compound Name: TRIDIHEXETHYL CHLORIDE
Compound Identifier: 701488
Mol Structure 2D: 701488
Molecular Weight: 354
Formula: C21 H36 N O . Cl
Development Status: Preclinical
SMILES: [Cl-].CC[N+](CC)(CC)CCC(O)(C1CCCCC1)c2ccccc2
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222342D 0 0.00000 0.00000 0^^ 24 24 0 0 0 999 V2000^ -1.6833 0.0000 0.0000 C 0 0 3 0 0 0 0 0 0^ -0.4833 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3250 1.0458 0.0000 N 0 3 3 0 0 0 0 0 0^ -1.6833 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0917 1.0458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6833 1.2000 0.0000 C 0 0 3 0 0 0 0 0 0^ -2.8833 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3250 -0.1792 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3250 2.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5167 1.0458 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6375 -1.7792 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7250 -1.8042 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7250 1.8125 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6375 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2792 -0.7625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.3375 2.8333 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1042 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6375 -2.9750 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7250 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7250 3.0083 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6375 2.9833 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6833 3.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6833 -3.5875 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3875 -1.6167 0.0000 Cl 0 5 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 5 1 0 0 0^ 4 1 1 0 0 0^ 5 2 1 0 0 0^ 6 1 1 0 0 0^ 7 1 1 0 0 0^ 8 3 1 0 0 0^ 9 3 1 0 0 0^ 10 3 1 0 0 0^ 11 4 1 0 0 0^ 12 4 2 0 0 0^ 13 6 1 0 0 0^ 14 6 1 0 0 0^ 15 8 1 0 0 0^ 16 9 1 0 0 0^ 17 10 1 0 0 0^ 18 11 2 0 0 0^ 19 12 1 0 0 0^ 20 13 1 0 0 0^ 21 14 1 0 0 0^ 22 21 1 0 0 0^ 23 19 2 0 0 0^ 22 20 1 0 0 0^ 23 18 1 0 0 0^M CHG 2 3 1 24 -1^M END^^
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