3-phenylpropyl 4-[[4-[ethyl(phenyl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[[4-[ethyl(phenyl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[4-[ethyl(phenyl)sulfamoyl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[ethyl(phenyl)sulfamoyl]anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-[ethyl(phenyl)sulfamoyl]anilino]-4-oxobutanoate Traditional Name: 4-[4-[ethyl(phenyl)sulfamoyl]anilino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O5S/c1-2-29(24-13-7-4-8-14-24)35(32,33)25-17-15-23(16-18-25)28-26(30)19-20-27(31)34-21-9-12-22-10-5-3-6-11-22/h3-8,10-11,13-18H,2,9,12,19-21H2,1H3,(H,28,30)