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

Systemtic Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-ethoxy-phenyl]piperazine hydrochloride Openeye Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-ethoxy-phenyl]piperazine hydrochloride CAS Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-ethoxyphenyl]piperazine hydrochloride IUPAC Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-ethoxyphenyl]piperazine hydrochloride Traditional Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-ethoxy-phenyl]piperazine hydrochloride Formula: C26H45ClN2O MolecularWeight: 437.1013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H44N2O.ClH/c1-6-8-15-27-16-18-28(19-17-27)25-20-23(29-7-2)13-14-24(25)21-9-11-22(12-10-21)26(3,4)5;/h13-14,20-22H,6-12,15-19H2,1-5H3;1H