[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] (3S)-1-benzyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] (3S)-1-benzyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-benzyl-5-keto-pyrrolidine-3-carboxylic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)[C@H]2CC(=O)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5/c1-15(26)23-18-7-9-19(10-8-18)24-20(27)14-30-22(29)17-11-21(28)25(13-17)12-16-5-3-2-4-6-16/h2-10,17H,11-14H2,1H3,(H,23,26)(H,24,27)/t17-/m0/s1