1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-pyridin-2-yl-phenyl]piperazine hydrochloride

Systemtic Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-pyridin-2-yl-phenyl]piperazine hydrochloride Openeye Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-(2-pyridyl)phenyl]piperazine hydrochloride CAS Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-(2-pyridinyl)phenyl]piperazine hydrochloride IUPAC Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-pyridin-2-ylphenyl]piperazine hydrochloride Traditional Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-4-(2-pyridyl)phenyl]piperazine hydrochloride Formula: C29H44ClN3 MolecularWeight: 470.13276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=CC=N3)C4CCC(CC4)C(C)(C)C.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=CC=N3)C4CCC(CC4)C(C)(C)C.Cl

InChI

InChI=1S/C29H43N3.ClH/c1-5-6-17-31-18-20-32(21-19-31)28-15-12-24(27-9-7-8-16-30-27)22-26(28)23-10-13-25(14-11-23)29(2,3)4;/h7-9,12,15-16,22-23,25H,5-6,10-11,13-14,17-21H2,1-4H3;1H