2,6-dimethylheptan-4-yl 1-[(4-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylate

Systemtic Name: 2,6-dimethylheptan-4-yl 1-[(4-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylate Openeye Name: (1-isobutyl-3-methyl-butyl) 1-[(4-chlorophenyl)methyl]-5-oxo-pyrrolidine-2-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid 2,6-dimethylheptan-4-yl ester IUPAC Name: 2,6-dimethylheptan-4-yl 1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate Traditional Name: 1-(4-chlorobenzyl)-5-keto-pyrrolidine-2-carboxylic acid (1-isobutyl-3-methyl-butyl) ester Formula: C21H30ClNO3 MolecularWeight: 379.9208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)OC(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(CC(C)C)OC(=O)C1CCC(=O)N1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H30ClNO3/c1-14(2)11-18(12-15(3)4)26-21(25)19-9-10-20(24)23(19)13-16-5-7-17(22)8-6-16/h5-8,14-15,18-19H,9-13H2,1-4H3