2-methyl-2-(1-methylpiperazin-1-ium-1-yl)-1-[4-(phenylcarbonyl)phenyl]propan-1-one

Systemtic Name: 2-methyl-2-(1-methylpiperazin-1-ium-1-yl)-1-[4-(phenylcarbonyl)phenyl]propan-1-one Openeye Name: 1-(4-benzoylphenyl)-2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propan-1-one CAS Name: 1-(4-benzoylphenyl)-2-methyl-2-(1-methyl-1-piperazin-1-iumyl)-1-propanone IUPAC Name: 1-(4-benzoylphenyl)-2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propan-1-one Traditional Name: 1-(4-benzoylphenyl)-2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propan-1-one Formula: C22H27N2O2+ MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)[N+]3(CCNCC3)C

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2)[N+]3(CCNCC3)C

InChI

InChI=1S/C22H27N2O2/c1-22(2,24(3)15-13-23-14-16-24)21(26)19-11-9-18(10-12-19)20(25)17-7-5-4-6-8-17/h4-12,23H,13-16H2,1-3H3/q+1