Viewing Compound With Structures

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Compound Report Overview

Compound Name: ROXARSONE
Compound Identifier: 700770
Mol Structure 2D: 700770
Molecular Weight: 263
Formula: C6 H6 As N O6
Development Status: Environmental Pollutant
SMILES: Oc1ccc(cc1[N+](=O)[O-])[As](=O)(O)O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222212D 0 0.00000 0.00000 0^^ 14 14 0 0 0 999 V2000^ -1.3833 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1250 1.2333 0.0000 N 0 3 0 0 0 0 0 0 0^ 2.2167 -1.2000 0.0000 As 0 0 0 0 0 0 0 0 0^ 0.0792 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7667 -1.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0708 -1.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.5250 1.1583 0.0000 O 0 5 0 0 0 0 0 0 0^ -1.4583 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.6417 -1.2000 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.0792 -2.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.2167 0.2583 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.2167 -2.6542 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.3833 -2.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.5250 -1.2000 0.0000 O 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 5 1 0 0 0^ 4 1 2 0 0 0^ 5 4 1 0 0 0^ 6 1 1 0 0 0^ 7 2 1 0 0 0^ 8 2 2 0 0 0^ 9 3 2 0 0 0^ 10 13 1 0 0 0^ 11 3 1 0 0 0^ 12 3 1 0 0 0^ 13 6 2 0 0 0^ 14 6 1 0 0 0^ 10 5 2 0 0 0^M CHG 2 2 1 7 -1^M END^^
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