1-(4-cyclohexylpiperazine-1,4-diium-1-yl)-3-(3-methylphenoxy)propan-2-ol dichloride

Systemtic Name: 1-(4-cyclohexylpiperazine-1,4-diium-1-yl)-3-(3-methylphenoxy)propan-2-ol dichloride Openeye Name: 1-(4-cyclohexylpiperazine-1,4-diium-1-yl)-3-(3-methylphenoxy)propan-2-ol dichloride CAS Name: 1-(4-cyclohexyl-1-piperazine-1,4-diiumyl)-3-(3-methylphenoxy)-2-propanol dichloride IUPAC Name: 1-(4-cyclohexylpiperazine-1,4-diium-1-yl)-3-(3-methylphenoxy)propan-2-ol dichloride Traditional Name: 1-(4-cyclohexylpiperazine-1,4-diium-1-yl)-3-(3-methylphenoxy)propan-2-ol dichloride Formula: C20H34Cl2N2O2 MolecularWeight: 405.40216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(C[NH+]2CC[NH+](CC2)C3CCCCC3)O.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(C[NH+]2CC[NH+](CC2)C3CCCCC3)O.[Cl-].[Cl-]

InChI

InChI=1S/C20H32N2O2.2ClH/c1-17-6-5-9-20(14-17)24-16-19(23)15-21-10-12-22(13-11-21)18-7-3-2-4-8-18;;/h5-6,9,14,18-19,23H,2-4,7-8,10-13,15-16H2,1H3;2*1H