[2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: [2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: [2-(2-chloro-5-nitro-anilino)-2-oxo-ethyl] 3-[allyl-(2-methoxyphenyl)sulfamoyl]benzoate CAS Name: 3-[(2-methoxyphenyl)-prop-2-enylsulfamoyl]benzoic acid [2-(2-chloro-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-5-nitroanilino)-2-oxoethyl] 3-[(2-methoxyphenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(2-methoxyphenyl)sulfamoyl]benzoic acid [2-(2-chloro-5-nitro-anilino)-2-keto-ethyl] ester Formula: C25H22ClN3O8S MolecularWeight: 559.97548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC=C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=CC=C1N(CC=C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H22ClN3O8S/c1-3-13-28(22-9-4-5-10-23(22)36-2)38(34,35)19-8-6-7-17(14-19)25(31)37-16-24(30)27-21-15-18(29(32)33)11-12-20(21)26/h3-12,14-15H,1,13,16H2,2H3,(H,27,30)