methyl (2S,4S,5R)-4-(2-acetamidoethylcarbamoyl)-1,2-dimethyl-5-(2-methylphenyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S,5R)-4-(2-acetamidoethylcarbamoyl)-1,2-dimethyl-5-(2-methylphenyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S,5R)-4-(2-acetamidoethylcarbamoyl)-1,2-dimethyl-5-(o-tolyl)pyrrolidine-2-carboxylate CAS Name: (2S,4S,5R)-4-[(2-acetamidoethylamino)-oxomethyl]-1,2-dimethyl-5-(2-methylphenyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S,5R)-4-(2-acetamidoethylcarbamoyl)-1,2-dimethyl-5-(2-methylphenyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4S,5R)-4-(2-acetamidoethylcarbamoyl)-1,2-dimethyl-5-(o-tolyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C20H29N3O4 MolecularWeight: 375.46196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(CC(N2C)(C)C(=O)OC)C(=O)NCCNC(=O)C

Isomeric SMILES

CC1=CC=CC=C1[C@H]2[C@H](C[C@@](N2C)(C)C(=O)OC)C(=O)NCCNC(=O)C

InChI

InChI=1S/C20H29N3O4/c1-13-8-6-7-9-15(13)17-16(18(25)22-11-10-21-14(2)24)12-20(3,23(17)4)19(26)27-5/h6-9,16-17H,10-12H2,1-5H3,(H,21,24)(H,22,25)/t16-,17-,20-/m0/s1