1-[2-tert-butyl-4-[phenyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[phenyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[phenyl-[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[phenyl-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[phenyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[phenyl-[4-(2-piperidinoethoxy)phenyl]methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C35H52N4O2 MolecularWeight: 560.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C35H52N4O2/c1-35(2,3)32-27-38(22-23-39(32)33(40)26-28-16-18-36-19-17-28)34(29-10-6-4-7-11-29)30-12-14-31(15-13-30)41-25-24-37-20-8-5-9-21-37/h4,6-7,10-15,28,32,34,36H,5,8-9,16-27H2,1-3H3