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

Systemtic Name: 3-phenylpropyl 4-[[4-(dimethylsulfamoyl)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[4-(dimethylsulfamoyl)anilino]-4-oxo-butanoate CAS Name: 4-[4-(dimethylsulfamoyl)anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-(dimethylsulfamoyl)anilino]-4-oxobutanoate Traditional Name: 4-[4-(dimethylsulfamoyl)anilino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5S/c1-23(2)29(26,27)19-12-10-18(11-13-19)22-20(24)14-15-21(25)28-16-6-9-17-7-4-3-5-8-17/h3-5,7-8,10-13H,6,9,14-16H2,1-2H3,(H,22,24)