tert-butyl 4-[4-[4-(phenylmethyl)piperidin-1-yl]carbonylpiperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-(phenylmethyl)piperidin-1-yl]carbonylpiperidin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-benzylpiperidine-1-carbonyl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1-piperidinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-benzylpiperidine-1-carbonyl)piperidino]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H43N3O3 MolecularWeight: 469.65932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCC(CC2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCC(CC2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H43N3O3/c1-28(2,3)34-27(33)31-19-13-25(14-20-31)29-17-11-24(12-18-29)26(32)30-15-9-23(10-16-30)21-22-7-5-4-6-8-22/h4-8,23-25H,9-21H2,1-3H3