5,7-dimethyl-3-[[[4-(4-methylpiperazin-1-ium-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one

Systemtic Name: 5,7-dimethyl-3-[[[4-(4-methylpiperazin-1-ium-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one Openeye Name: 5,7-dimethyl-3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]-1H-quinolin-2-one CAS Name: 5,7-dimethyl-3-[[4-(4-methyl-1-piperazin-1-iumyl)anilino]methyl]-1H-quinolin-2-one IUPAC Name: 5,7-dimethyl-3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]-1H-quinolin-2-one Traditional Name: 5,7-dimethyl-3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]carbostyril Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CNC3=CC=C(C=C3)[NH+]4CCN(CC4)C)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CNC3=CC=C(C=C3)[NH+]4CCN(CC4)C)C

InChI

InChI=1S/C23H28N4O/c1-16-12-17(2)21-14-18(23(28)25-22(21)13-16)15-24-19-4-6-20(7-5-19)27-10-8-26(3)9-11-27/h4-7,12-14,24H,8-11,15H2,1-3H3,(H,25,28)/p+1