(4-methoxycarbonylphenyl)methyl (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl (3S)-1-[(2-chlorophenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-chlorobenzyl)-5-keto-pyrrolidine-3-carboxylic acid (4-carbomethoxybenzyl) ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C2CC(=O)N(C2)CC3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)[C@H]2CC(=O)N(C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClNO5/c1-27-20(25)15-8-6-14(7-9-15)13-28-21(26)17-10-19(24)23(12-17)11-16-4-2-3-5-18(16)22/h2-9,17H,10-13H2,1H3/t17-/m0/s1