1,7-diphenylheptan-4-yl 1-(3,3-dimethyl-2-oxidanylidene-butanoyl)piperidine-2-carboxylate

Systemtic Name: 1,7-diphenylheptan-4-yl 1-(3,3-dimethyl-2-oxidanylidene-butanoyl)piperidine-2-carboxylate Openeye Name: [4-phenyl-1-(3-phenylpropyl)butyl] 1-(3,3-dimethyl-2-oxo-butanoyl)piperidine-2-carboxylate CAS Name: 1-(3,3-dimethyl-1,2-dioxobutyl)-2-piperidinecarboxylic acid 1,7-diphenylheptan-4-yl ester IUPAC Name: 1,7-diphenylheptan-4-yl 1-(3,3-dimethyl-2-oxobutanoyl)piperidine-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-butanoyl)pipecolinic acid [4-phenyl-1-(3-phenylpropyl)butyl] ester Formula: C31H41NO4 MolecularWeight: 491.66154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C31H41NO4/c1-31(2,3)28(33)29(34)32-23-11-10-22-27(32)30(35)36-26(20-12-18-24-14-6-4-7-15-24)21-13-19-25-16-8-5-9-17-25/h4-9,14-17,26-27H,10-13,18-23H2,1-3H3