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

Systemtic Name: 2-(3-methylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide CAS Name: 2-(3-methylphenoxy)-N-[[1-(4-methyl-1-piperazin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Traditional Name: 2-(3-methylphenoxy)-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Formula: C21H34N3O2+ MolecularWeight: 360.51356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O2/c1-18-7-6-8-19(15-18)26-16-20(25)22-17-21(9-4-3-5-10-21)24-13-11-23(2)12-14-24/h6-8,15H,3-5,9-14,16-17H2,1-2H3,(H,22,25)/p+1