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

Systemtic Name: [2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 2-benzamidoethanoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-benzamidoacetate CAS Name: 2-benzamidoacetic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl] ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O6S/c25-19(15-30-20(26)14-22-21(27)16-6-2-1-3-7-16)23-17-8-10-18(11-9-17)31(28,29)24-12-4-5-13-24/h1-3,6-11H,4-5,12-15H2,(H,22,27)(H,23,25)