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

Systemtic Name: 1-butyl-4-[2-(4,4-dimethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine Openeye Name: 1-butyl-4-[2-(4,4-dimethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine CAS Name: 1-butyl-4-[2-(4,4-dimethylcyclohexyl)-4-(3-methoxy-1-pyrrolidinyl)phenyl]piperazine IUPAC Name: 1-butyl-4-[2-(4,4-dimethylcyclohexyl)-4-(3-methoxypyrrolidin-1-yl)phenyl]piperazine Traditional Name: 1-butyl-4-[2-(4,4-dimethylcyclohexyl)-4-(3-methoxypyrrolidino)phenyl]piperazine Formula: C27H45N3O MolecularWeight: 427.6657

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H45N3O/c1-5-6-14-28-16-18-29(19-17-28)26-8-7-23(30-15-11-24(21-30)31-4)20-25(26)22-9-12-27(2,3)13-10-22/h7-8,20,22,24H,5-6,9-19,21H2,1-4H3