tert-butyl 4-[2-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(1-benzyl-4-piperidyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-[1-(phenylmethyl)-4-piperidinyl]-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(1-benzylpiperidin-4-yl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(1-benzyl-4-piperidyl)piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H46N4O2 MolecularWeight: 470.69044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H46N4O2/c1-28(2,3)34-27(33)32-17-10-24(11-18-32)9-14-29-19-21-31(22-20-29)26-12-15-30(16-13-26)23-25-7-5-4-6-8-25/h4-8,24,26H,9-23H2,1-3H3