5-[2-[2,5-diethoxy-4-[(4-methoxyphenyl)carbonylamino]phenyl]-2-sulfino-hydrazinyl]oxy-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[2,5-diethoxy-4-[(4-methoxyphenyl)carbonylamino]phenyl]-2-sulfino-hydrazinyl]oxy-2-oxidanyl-benzoic acid Openeye Name: 5-[2-[2,5-diethoxy-4-[(4-methoxybenzoyl)amino]phenyl]-2-sulfino-hydrazino]oxy-2-hydroxy-benzoic acid CAS Name: 5-[2-[2,5-diethoxy-4-[[(4-methoxyphenyl)-oxomethyl]amino]phenyl]-2-sulfinohydrazinyl]oxy-2-hydroxybenzoic acid IUPAC Name: 5-[2-[2,5-diethoxy-4-[(4-methoxybenzoyl)amino]phenyl]-2-sulfinohydrazinyl]oxy-2-hydroxybenzoic acid Traditional Name: 5-[N'-[2,5-diethoxy-4-(p-anisoylamino)phenyl]-N'-sulfino-hydrazino]oxy-2-hydroxy-benzoic acid Formula: C25H27N3O10S MolecularWeight: 561.56098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)OC)OCC)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)OC)OCC)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)O

InChI

InChI=1S/C25H27N3O10S/c1-4-36-22-14-20(28(39(33)34)27-38-17-10-11-21(29)18(12-17)25(31)32)23(37-5-2)13-19(22)26-24(30)15-6-8-16(35-3)9-7-15/h6-14,27,29H,4-5H2,1-3H3,(H,26,30)(H,31,32)(H,33,34)