(4-ethylphenyl) (3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-ethylphenyl) (3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-ethylphenyl) (3S)-1-(3-chloro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3-chloro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (3S)-1-(3-chloro-4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-chloro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-ethylphenyl) ester Formula: C20H20ClNO3 MolecularWeight: 357.8307

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)[C@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C20H20ClNO3/c1-3-14-5-8-17(9-6-14)25-20(24)15-10-19(23)22(12-15)16-7-4-13(2)18(21)11-16/h4-9,11,15H,3,10,12H2,1-2H3/t15-/m0/s1