methyl (2S,4S)-4-acetamido-1-[(2,5-dimethylphenyl)methyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-4-acetamido-1-[(2,5-dimethylphenyl)methyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-4-acetamido-1-[(2,5-dimethylphenyl)methyl]pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-acetamido-1-[(2,5-dimethylphenyl)methyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-4-acetamido-1-[(2,5-dimethylphenyl)methyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-4-acetamido-1-(2,5-dimethylbenzyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CC(CC2C(=O)OC)NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C[C@H](C[C@H]2C(=O)OC)NC(=O)C

InChI

InChI=1S/C17H24N2O3/c1-11-5-6-12(2)14(7-11)9-19-10-15(18-13(3)20)8-16(19)17(21)22-4/h5-7,15-16H,8-10H2,1-4H3,(H,18,20)/t15-,16-/m0/s1