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

Systemtic Name: 3-phenylpropyl 4-[[4-(diethylsulfamoyl)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[4-(diethylsulfamoyl)anilino]-4-oxo-butanoate CAS Name: 4-[4-(diethylsulfamoyl)anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-(diethylsulfamoyl)anilino]-4-oxobutanoate Traditional Name: 4-[4-(diethylsulfamoyl)anilino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O5S/c1-3-25(4-2)31(28,29)21-14-12-20(13-15-21)24-22(26)16-17-23(27)30-18-8-11-19-9-6-5-7-10-19/h5-7,9-10,12-15H,3-4,8,11,16-18H2,1-2H3,(H,24,26)