3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-7-methoxy-1-methyl-quinolin-2-one

Systemtic Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-7-methoxy-1-methyl-quinolin-2-one Openeye Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-7-methoxy-1-methyl-quinolin-2-one CAS Name: 3-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-7-methoxy-1-methyl-2-quinolinone IUPAC Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-7-methoxy-1-methylquinolin-2-one Traditional Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-7-methoxy-1-methyl-carbostyril Formula: C22H25FN3O2+ MolecularWeight: 382.451203

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)OC)C=C(C1=O)C[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CN1C2=C(C=CC(=C2)OC)C=C(C1=O)C[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H24FN3O2/c1-24-21-14-18(28-2)8-7-16(21)13-17(22(24)27)15-25-9-11-26(12-10-25)20-6-4-3-5-19(20)23/h3-8,13-14H,9-12,15H2,1-2H3/p+1