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

Systemtic Name: 8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-6-(propan-2-ylamino)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Openeye Name: 8-(5-fluoro-2-hydroxy-benzoyl)-6-(isopropylamino)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one CAS Name: 8-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-6-(propan-2-ylamino)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one IUPAC Name: 8-(5-fluoro-2-hydroxybenzoyl)-6-(propan-2-ylamino)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Traditional Name: 8-(5-fluoro-2-hydroxy-benzoyl)-6-(isopropylamino)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Formula: C22H19FN3O3+ MolecularWeight: 392.402963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C2NC3=CC=CC=C3C(=O)[N+]2=CC(=C1)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

CC(C)NC1=C2NC3=CC=CC=C3C(=O)[N+]2=CC(=C1)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C22H18FN3O3/c1-12(2)24-18-9-13(20(28)16-10-14(23)7-8-19(16)27)11-26-21(18)25-17-6-4-3-5-15(17)22(26)29/h3-12,24H,1-2H3,(H,27,28)/p+1