[1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate

Systemtic Name: [1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate Openeye Name: [2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl] 5-oxo-1-phenethyl-pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid [1-(4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-cyanoanilino)-1-oxopropan-2-yl] 5-oxo-1-phenethylpyrrolidine-3-carboxylate Traditional Name: 5-keto-1-phenethyl-pyrrolidine-3-carboxylic acid [2-(4-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)OC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4/c1-16(22(28)25-20-9-7-18(14-24)8-10-20)30-23(29)19-13-21(27)26(15-19)12-11-17-5-3-2-4-6-17/h2-10,16,19H,11-13,15H2,1H3,(H,25,28)