1-(azocan-1-yl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-(azocan-1-yl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]piperazin-1-yl]ethanone Openeye Name: 1-(azocan-1-yl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]piperazin-1-yl]ethanone CAS Name: 1-(1-azocanyl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]piperazin-1-yl]ethanone Traditional Name: 1-(azocan-1-yl)-2-[4-[2-(4-tert-butylcyclohexyl)phenyl]piperazino]ethanone Formula: C29H47N3O MolecularWeight: 453.70298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C2=CC=CC=C2N3CCN(CC3)CC(=O)N4CCCCCCC4

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=CC=CC=C2N3CCN(CC3)CC(=O)N4CCCCCCC4

InChI

InChI=1S/C29H47N3O/c1-29(2,3)25-15-13-24(14-16-25)26-11-7-8-12-27(26)31-21-19-30(20-22-31)23-28(33)32-17-9-5-4-6-10-18-32/h7-8,11-12,24-25H,4-6,9-10,13-23H2,1-3H3