5-[2-(2-methoxy-4-phenylazanyl-phenyl)-2-sulfino-hydrazinyl]oxy-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-(2-methoxy-4-phenylazanyl-phenyl)-2-sulfino-hydrazinyl]oxy-2-oxidanyl-benzoic acid Openeye Name: 5-[2-(4-anilino-2-methoxy-phenyl)-2-sulfino-hydrazino]oxy-2-hydroxy-benzoic acid CAS Name: 5-[2-(4-anilino-2-methoxyphenyl)-2-sulfinohydrazinyl]oxy-2-hydroxybenzoic acid IUPAC Name: 5-[2-(4-anilino-2-methoxyphenyl)-2-sulfinohydrazinyl]oxy-2-hydroxybenzoic acid Traditional Name: 5-[N'-(4-anilino-2-methoxy-phenyl)-N'-sulfino-hydrazino]oxy-2-hydroxy-benzoic acid Formula: C20H19N3O7S MolecularWeight: 445.44576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=CC=CC=C2)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=CC=CC=C2)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)O

InChI

InChI=1S/C20H19N3O7S/c1-29-19-11-14(21-13-5-3-2-4-6-13)7-9-17(19)23(31(27)28)22-30-15-8-10-18(24)16(12-15)20(25)26/h2-12,21-22,24H,1H3,(H,25,26)(H,27,28)