[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] 3-[allyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 3-[allyl(phenyl)sulfamoyl]benzoic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C28H30N2O5S MolecularWeight: 506.6132

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=CC=C3

InChI

InChI=1S/C28H30N2O5S/c1-4-18-30(24-15-8-7-9-16-24)36(33,34)25-17-11-14-23(19-25)28(32)35-20-26(31)29-27-21(5-2)12-10-13-22(27)6-3/h4,7-17,19H,1,5-6,18,20H2,2-3H3,(H,29,31)