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5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoyl]phenolate

5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoyl]phenolate

Systemtic Name:5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoyl]phenolate
Openeye Name:5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]phenolate
CAS Name:5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)thio]-1-oxoethyl]phenolate
IUPAC Name:5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]phenolate
Traditional Name:5-methoxy-2-[2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetyl]phenolate
Formula: C16H12N3O5S-
MolecularWeight: 358.34858
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])[O-]


Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])[O-]


InChI

InChI=1S/C16H13N3O5S/c1-24-10-3-4-11(14(20)7-10)15(21)8-25-16-17-12-5-2-9(19(22)23)6-13(12)18-16/h2-7,20H,8H2,1H3,(H,17,18)/p-1


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