1-[4-[2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propanoyl]phenyl]-2-phenyl-ethane-1,2-dione

Systemtic Name: 1-[4-[2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propanoyl]phenyl]-2-phenyl-ethane-1,2-dione Openeye Name: 1-[4-[2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propanoyl]phenyl]-2-phenyl-ethane-1,2-dione CAS Name: 1-[4-[2-methyl-2-(1-methyl-1-piperazin-1-iumyl)-1-oxopropyl]phenyl]-2-phenylethane-1,2-dione IUPAC Name: 1-[4-[2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propanoyl]phenyl]-2-phenylethane-1,2-dione Traditional Name: 1-[4-[2-methyl-2-(1-methylpiperazin-1-ium-1-yl)propanoyl]phenyl]-2-phenyl-ethane-1,2-dione Formula: C23H27N2O3+ MolecularWeight: 379.47208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N2O3/c1-23(2,25(3)15-13-24-14-16-25)22(28)19-11-9-18(10-12-19)21(27)20(26)17-7-5-4-6-8-17/h4-12,24H,13-16H2,1-3H3/q+1