(3,4-dimethoxyphenyl)methyl-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[[1-(4-methyl-1-piperazin-4-iumyl)cyclohexyl]methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]azanium Traditional Name: [1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl-veratryl-ammonium Formula: C21H37N3O2+2 MolecularWeight: 363.53738

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2(CCCCC2)C[NH2+]CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2(CCCCC2)C[NH2+]CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H35N3O2/c1-23-11-13-24(14-12-23)21(9-5-4-6-10-21)17-22-16-18-7-8-19(25-2)20(15-18)26-3/h7-8,15,22H,4-6,9-14,16-17H2,1-3H3/p+2