(4-ethylphenyl) (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-ethylphenyl) (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-ethylphenyl) (3S)-1-(5-chloro-2-methoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(5-chloro-2-methoxy-phenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-ethylphenyl) ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClNO4/c1-3-13-4-7-16(8-5-13)26-20(24)14-10-19(23)22(12-14)17-11-15(21)6-9-18(17)25-2/h4-9,11,14H,3,10,12H2,1-2H3/t14-/m0/s1