2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-1-(2-phenylethynyl)cyclohexan-1-ol

Systemtic Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-1-(2-phenylethynyl)cyclohexan-1-ol Openeye Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-1-(2-phenylethynyl)cyclohexanol CAS Name: 2-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-1-(2-phenylethynyl)-1-cyclohexanol IUPAC Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-1-(2-phenylethynyl)cyclohexan-1-ol Traditional Name: 2-[[4-(2-chlorophenyl)piperazino]methyl]-1-(2-phenylethynyl)cyclohexanol Formula: C25H29ClN2O MolecularWeight: 408.96356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CN2CCN(CC2)C3=CC=CC=C3Cl)(C#CC4=CC=CC=C4)O

Isomeric SMILES

C1CCC(C(C1)CN2CCN(CC2)C3=CC=CC=C3Cl)(C#CC4=CC=CC=C4)O

InChI

InChI=1S/C25H29ClN2O/c26-23-11-4-5-12-24(23)28-18-16-27(17-19-28)20-22-10-6-7-14-25(22,29)15-13-21-8-2-1-3-9-21/h1-5,8-9,11-12,22,29H,6-7,10,14,16-20H2