2-(2,3-dimethylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide Openeye Name: 2-(2,3-dimethylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[[1-(4-methyl-1-piperazin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-(2,3-dimethylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Traditional Name: 2-(2,3-dimethylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Formula: C22H36N3O2+ MolecularWeight: 374.54014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NCC2(CCCCC2)[NH+]3CCN(CC3)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NCC2(CCCCC2)[NH+]3CCN(CC3)C)C

InChI

InChI=1S/C22H35N3O2/c1-18-8-7-9-20(19(18)2)27-16-21(26)23-17-22(10-5-4-6-11-22)25-14-12-24(3)13-15-25/h7-9H,4-6,10-17H2,1-3H3,(H,23,26)/p+1