4-[(4-methoxycarbonylphenyl)disulfanyl]-2-nitro-benzoic acid

Systemtic Name: 4-[(4-methoxycarbonylphenyl)disulfanyl]-2-nitro-benzoic acid Openeye Name: 4-[(4-methoxycarbonylphenyl)disulfanyl]-2-nitro-benzoic acid CAS Name: 4-[(4-methoxycarbonylphenyl)disulfanyl]-2-nitrobenzoic acid IUPAC Name: 4-[(4-methoxycarbonylphenyl)disulfanyl]-2-nitrobenzoic acid Traditional Name: 4-[(4-carbomethoxyphenyl)disulfanyl]-2-nitro-benzoic acid Formula: C15H11NO6S2 MolecularWeight: 365.38094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)SSC2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)SSC2=CC(=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H11NO6S2/c1-22-15(19)9-2-4-10(5-3-9)23-24-11-6-7-12(14(17)18)13(8-11)16(20)21/h2-8H,1H3,(H,17,18)