methyl (2S,3S,4R,5R)-4-(4-chlorophenyl)carbonyl-3,5-diphenyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5R)-4-(4-chlorophenyl)carbonyl-3,5-diphenyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R,5R)-4-(4-chlorobenzoyl)-3,5-diphenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R,5R)-4-[(4-chlorophenyl)-oxomethyl]-3,5-diphenyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5R)-4-(4-chlorobenzoyl)-3,5-diphenylpyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R,5R)-4-(4-chlorobenzoyl)-3,5-diphenyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C25H22ClNO3 MolecularWeight: 419.90008

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(C(N1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H]1[C@@H]([C@H]([C@@H](N1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H22ClNO3/c1-30-25(29)23-20(16-8-4-2-5-9-16)21(22(27-23)17-10-6-3-7-11-17)24(28)18-12-14-19(26)15-13-18/h2-15,20-23,27H,1H3/t20-,21-,22+,23+/m1/s1