1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methyl-phenyl]piperazine hydrochloride

Systemtic Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methyl-phenyl]piperazine hydrochloride Openeye Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methyl-phenyl]piperazine hydrochloride CAS Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methylphenyl]piperazine hydrochloride IUPAC Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methylphenyl]piperazine hydrochloride Traditional Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-methyl-phenyl]piperazine hydrochloride Formula: C25H43ClN2 MolecularWeight: 407.07532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C)C3CCC(CC3)C(C)(C)C.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C)C3CCC(CC3)C(C)(C)C.Cl

InChI

InChI=1S/C25H42N2.ClH/c1-6-7-14-26-15-17-27(18-16-26)24-19-20(2)8-13-23(24)21-9-11-22(12-10-21)25(3,4)5;/h8,13,19,21-22H,6-7,9-12,14-18H2,1-5H3;1H