3-[[[4-(4-methylpiperazin-1-ium-1-yl)phenyl]amino]methyl]-6-propyl-1H-quinolin-2-one

Systemtic Name: 3-[[[4-(4-methylpiperazin-1-ium-1-yl)phenyl]amino]methyl]-6-propyl-1H-quinolin-2-one Openeye Name: 3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]-6-propyl-1H-quinolin-2-one CAS Name: 3-[[4-(4-methyl-1-piperazin-1-iumyl)anilino]methyl]-6-propyl-1H-quinolin-2-one IUPAC Name: 3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]-6-propyl-1H-quinolin-2-one Traditional Name: 3-[[4-(4-methylpiperazin-1-ium-1-yl)anilino]methyl]-6-propyl-carbostyril Formula: C24H31N4O+ MolecularWeight: 391.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)NC(=O)C(=C2)CNC3=CC=C(C=C3)[NH+]4CCN(CC4)C

Isomeric SMILES

CCCC1=CC2=C(C=C1)NC(=O)C(=C2)CNC3=CC=C(C=C3)[NH+]4CCN(CC4)C

InChI

InChI=1S/C24H30N4O/c1-3-4-18-5-10-23-19(15-18)16-20(24(29)26-23)17-25-21-6-8-22(9-7-21)28-13-11-27(2)12-14-28/h5-10,15-16,25H,3-4,11-14,17H2,1-2H3,(H,26,29)/p+1