[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: [2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate Openeye Name: [2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl] 5-[(4-ethoxyphenyl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-ethoxyphenyl)sulfamoyl]-2-methylbenzoic acid [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] 5-[(4-ethoxyphenyl)sulfamoyl]-2-methylbenzoate Traditional Name: 2-methyl-5-(p-phenetylsulfamoyl)benzoic acid [2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl] ester Formula: C26H27N3O9S MolecularWeight: 557.57228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)NC3=CC(=C(C=C3C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC(=O)NC3=CC(=C(C=C3C)[N+](=O)[O-])OC

InChI

InChI=1S/C26H27N3O9S/c1-5-37-19-9-7-18(8-10-19)28-39(34,35)20-11-6-16(2)21(13-20)26(31)38-15-25(30)27-22-14-24(36-4)23(29(32)33)12-17(22)3/h6-14,28H,5,15H2,1-4H3,(H,27,30)