Viewing Compound With Structures

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Compound Report Overview

Compound Name: BETA-CCB
Compound Identifier: 704366
Mol Structure 2D: 704366
Molecular Weight: 268
Formula: C16 H16 N2 O2
Development Status: Biochemical standard
SMILES: CCCCOC(=O)c1cc2c(cn1)[nH]c3ccccc32
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222052D 0 0.00000 0.00000 0^^ 20 22 0 0 0 999 V2000^ -2.1208 -1.7000 0.0000 N 0 0 0 0 0 0 0 0 0^ -1.6458 -0.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3625 -1.1792 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.5458 -0.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.8333 -1.1667 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0208 0.3833 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1250 0.2083 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.1500 -0.6625 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.4792 0.9125 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4500 -1.3500 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.1917 1.7625 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3750 0.7208 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.1583 0.3750 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.7458 -1.3500 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9792 1.3833 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.8667 1.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4667 1.8750 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0833 0.1833 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 -0.6667 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 1.7000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 3 2 0 0 0^ 3 1 1 0 0 0^ 4 5 2 0 0 0^ 5 1 1 0 0 0^ 6 2 1 0 0 0^ 7 8 1 0 0 0^ 8 10 2 0 0 0^ 9 7 1 0 0 0^ 10 3 1 0 0 0^ 11 9 2 0 0 0^ 12 9 1 0 0 0^ 13 4 1 0 0 0^ 14 5 1 0 0 0^ 15 12 1 0 0 0^ 16 15 1 0 0 0^ 17 16 1 0 0 0^ 18 19 1 0 0 0^ 19 14 2 0 0 0^ 20 17 1 0 0 0^ 4 2 1 0 0 0^ 18 13 2 0 0 0^ 7 6 2 0 0 0^M END^^
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