1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine hydrochloride

Systemtic Name: 1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine hydrochloride Openeye Name: 1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine hydrochloride CAS Name: 1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxy-1-pyrrolidinyl)phenyl]piperazine hydrochloride IUPAC Name: 1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine hydrochloride Traditional Name: 1-butyl-4-[2-(4,4-diethylcyclohexyl)-4-(3-methoxypyrrolidino)phenyl]piperazine hydrochloride Formula: C29H50ClN3O MolecularWeight: 492.1798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCC(C3)OC)C4CCC(CC4)(CC)CC.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCC(C3)OC)C4CCC(CC4)(CC)CC.Cl

InChI

InChI=1S/C29H49N3O.ClH/c1-5-8-16-30-18-20-31(21-19-30)28-10-9-25(32-17-13-26(23-32)33-4)22-27(28)24-11-14-29(6-2,7-3)15-12-24;/h9-10,22,24,26H,5-8,11-21,23H2,1-4H3;1H