1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenyl-ethanolate

Systemtic Name: 1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenyl-ethanolate Openeye Name: 1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenyl-ethanolate CAS Name: 1-cyclohexyl-2-(4,4-dimethyl-1-piperazin-4-iumyl)-1-phenylethanolate IUPAC Name: 1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenylethanolate Traditional Name: 1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenyl-ethanolate Formula: C20H32N2O MolecularWeight: 316.48088

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)CC(C2CCCCC2)(C3=CC=CC=C3)[O-])C

Isomeric SMILES

C[N+]1(CCN(CC1)CC(C2CCCCC2)(C3=CC=CC=C3)[O-])C

InChI

InChI=1S/C20H32N2O/c1-22(2)15-13-21(14-16-22)17-20(23,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3,5-6,9-10,19H,4,7-8,11-17H2,1-2H3