1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxypiperidin-1-yl)phenyl]piperazin-1-yl]butan-2-one

Systemtic Name: 1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxypiperidin-1-yl)phenyl]piperazin-1-yl]butan-2-one Openeye Name: 1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxy-1-piperidyl)phenyl]piperazin-1-yl]butan-2-one CAS Name: 1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxy-1-piperidinyl)phenyl]-1-piperazinyl]-2-butanone IUPAC Name: 1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxypiperidin-1-yl)phenyl]piperazin-1-yl]butan-2-one Traditional Name: 1-[4-[2-(4,4-dimethylcyclohexyl)-4-(4-methoxypiperidino)phenyl]piperazino]butan-2-one Formula: C28H45N3O2 MolecularWeight: 455.6758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)N3CCC(CC3)OC)C4CCC(CC4)(C)C

Isomeric SMILES

CCC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)N3CCC(CC3)OC)C4CCC(CC4)(C)C

InChI

InChI=1S/C28H45N3O2/c1-5-24(32)21-29-16-18-31(19-17-29)27-7-6-23(30-14-10-25(33-4)11-15-30)20-26(27)22-8-12-28(2,3)13-9-22/h6-7,20,22,25H,5,8-19,21H2,1-4H3