1-[2-(4,4-dimethylcyclohexyl)-4-pyrrolidin-1-yl-phenyl]-4-(2-methylpropyl)piperazine hydrochloride

Systemtic Name: 1-[2-(4,4-dimethylcyclohexyl)-4-pyrrolidin-1-yl-phenyl]-4-(2-methylpropyl)piperazine hydrochloride Openeye Name: 1-[2-(4,4-dimethylcyclohexyl)-4-pyrrolidin-1-yl-phenyl]-4-isobutyl-piperazine hydrochloride CAS Name: 1-[2-(4,4-dimethylcyclohexyl)-4-(1-pyrrolidinyl)phenyl]-4-(2-methylpropyl)piperazine hydrochloride IUPAC Name: 1-[2-(4,4-dimethylcyclohexyl)-4-pyrrolidin-1-ylphenyl]-4-(2-methylpropyl)piperazine hydrochloride Traditional Name: 1-[2-(4,4-dimethylcyclohexyl)-4-pyrrolidino-phenyl]-4-isobutyl-piperazine hydrochloride Formula: C26H44ClN3 MolecularWeight: 434.10066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=C(C=C(C=C2)N3CCCC3)C4CCC(CC4)(C)C.Cl

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=C(C=C(C=C2)N3CCCC3)C4CCC(CC4)(C)C.Cl

InChI

InChI=1S/C26H43N3.ClH/c1-21(2)20-27-15-17-29(18-16-27)25-8-7-23(28-13-5-6-14-28)19-24(25)22-9-11-26(3,4)12-10-22;/h7-8,19,21-22H,5-6,9-18,20H2,1-4H3;1H