7,7-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-phenyl-6,8-dihydroquinoline-2,5-dione

Systemtic Name: 7,7-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-phenyl-6,8-dihydroquinoline-2,5-dione Openeye Name: 7,7-dimethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-phenyl-6,8-dihydroquinoline-2,5-dione CAS Name: 7,7-dimethyl-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-phenyl-6,8-dihydroquinoline-2,5-dione IUPAC Name: 7,7-dimethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-phenyl-6,8-dihydroquinoline-2,5-dione Traditional Name: 7,7-dimethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-phenyl-6,8-dihydroquinoline-2,5-quinone Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=O)N2C3=CC=CC=C3)C(=O)N4CC[NH+](CC4)C)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=O)N2C3=CC=CC=C3)C(=O)N4CC[NH+](CC4)C)C(=O)C1)C

InChI

InChI=1S/C23H27N3O3/c1-23(2)14-19-17(20(27)15-23)13-18(21(28)25-11-9-24(3)10-12-25)22(29)26(19)16-7-5-4-6-8-16/h4-8,13H,9-12,14-15H2,1-3H3/p+1