1-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]-3,3,5,5-tetramethyl-cyclohexan-1-ol

Systemtic Name: 1-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]-3,3,5,5-tetramethyl-cyclohexan-1-ol Openeye Name: 1-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]-3,3,5,5-tetramethyl-cyclohexanol CAS Name: 1-[1-(3-bromophenyl)-2-(1-piperazinyl)ethyl]-3,3,5,5-tetramethyl-1-cyclohexanol IUPAC Name: 1-[1-(3-bromophenyl)-2-piperazin-1-ylethyl]-3,3,5,5-tetramethylcyclohexan-1-ol Traditional Name: 1-[1-(3-bromophenyl)-2-piperazino-ethyl]-3,3,5,5-tetramethyl-cyclohexanol Formula: C22H35BrN2O MolecularWeight: 423.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C(CN2CCNCC2)C3=CC(=CC=C3)Br)O)(C)C)C

Isomeric SMILES

CC1(CC(CC(C1)(C(CN2CCNCC2)C3=CC(=CC=C3)Br)O)(C)C)C

InChI

InChI=1S/C22H35BrN2O/c1-20(2)14-21(3,4)16-22(26,15-20)19(13-25-10-8-24-9-11-25)17-6-5-7-18(23)12-17/h5-7,12,19,24,26H,8-11,13-16H2,1-4H3