(2-oxidanylidene-2-phenylazanyl-ethyl) (3S)-1-[(4-chlorophenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (3S)-1-[(4-chlorophenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) (3S)-1-[(4-chlorobenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[[(4-chlorophenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (3S)-1-[(4-chlorobenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-[(4-chlorobenzoyl)amino]-5-keto-pyrrolidine-3-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)NC(=O)C2=CC=C(C=C2)Cl)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](CN(C1=O)NC(=O)C2=CC=C(C=C2)Cl)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3O5/c21-15-8-6-13(7-9-15)19(27)23-24-11-14(10-18(24)26)20(28)29-12-17(25)22-16-4-2-1-3-5-16/h1-9,14H,10-12H2,(H,22,25)(H,23,27)/t14-/m0/s1