8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-6-(4-methylpiperazin-4-ium-1-yl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one

Systemtic Name: 8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-6-(4-methylpiperazin-4-ium-1-yl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Openeye Name: 8-(5-fluoro-2-hydroxy-benzoyl)-6-(4-methylpiperazin-4-ium-1-yl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one CAS Name: 8-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-6-(4-methyl-1-piperazin-4-iumyl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one IUPAC Name: 8-(5-fluoro-2-hydroxybenzoyl)-6-(4-methylpiperazin-4-ium-1-yl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Traditional Name: 8-(5-fluoro-2-hydroxy-benzoyl)-6-(4-methylpiperazin-4-ium-1-yl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Formula: C24H23FN4O3+2 MolecularWeight: 434.462823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C3NC4=CC=CC=C4C(=O)[N+]3=CC(=C2)C(=O)C5=C(C=CC(=C5)F)O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C3NC4=CC=CC=C4C(=O)[N+]3=CC(=C2)C(=O)C5=C(C=CC(=C5)F)O

InChI

InChI=1S/C24H21FN4O3/c1-27-8-10-28(11-9-27)20-12-15(22(31)18-13-16(25)6-7-21(18)30)14-29-23(20)26-19-5-3-2-4-17(19)24(29)32/h2-7,12-14H,8-11H2,1H3,(H,30,31)/p+2