[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-methoxyphenyl)sulfamoyl]benzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-methoxyphenyl)sulfamoyl]benzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)/N

InChI

InChI=1S/C20H19N3O6S/c1-13(22)18(11-21)19(24)12-29-20(25)14-4-3-5-17(10-14)30(26,27)23-15-6-8-16(28-2)9-7-15/h3-10,23H,12,22H2,1-2H3/b18-13+