methyl (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methyl-pyrrolidine-2-carboxylate CAS Name: (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methylpyrrolidine-2-carboxylate Traditional Name: (2S,4R,5R)-5-(2-chlorophenyl)-4-cyano-2-methyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C14H15ClN2O2 MolecularWeight: 278.7341

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(N1)C2=CC=CC=C2Cl)C#N)C(=O)OC

Isomeric SMILES

C[C@]1(C[C@H]([C@@H](N1)C2=CC=CC=C2Cl)C#N)C(=O)OC

InChI

InChI=1S/C14H15ClN2O2/c1-14(13(18)19-2)7-9(8-16)12(17-14)10-5-3-4-6-11(10)15/h3-6,9,12,17H,7H2,1-2H3/t9-,12+,14-/m0/s1