[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 3-phenylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 3-phenylpropanoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c24-20(16-28-21(25)13-8-17-6-2-1-3-7-17)22-18-9-11-19(12-10-18)29(26,27)23-14-4-5-15-23/h1-3,6-7,9-12H,4-5,8,13-16H2,(H,22,24)