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

Systemtic Name: 3-chloranyl-6-(ethylamino)-8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Openeye Name: 3-chloro-6-(ethylamino)-8-(5-fluoro-2-hydroxy-benzoyl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one CAS Name: 3-chloro-6-(ethylamino)-8-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-5H-pyrido[2,1-b]quinazolin-10-ium-11-one IUPAC Name: 3-chloro-6-(ethylamino)-8-(5-fluoro-2-hydroxybenzoyl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Traditional Name: 3-chloro-6-(ethylamino)-8-(5-fluoro-2-hydroxy-benzoyl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Formula: C21H16ClFN3O3+ MolecularWeight: 412.821443

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2NC3=C(C=CC(=C3)Cl)C(=O)[N+]2=CC(=C1)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

CCNC1=C2NC3=C(C=CC(=C3)Cl)C(=O)[N+]2=CC(=C1)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C21H15ClFN3O3/c1-2-24-17-7-11(19(28)15-9-13(23)4-6-18(15)27)10-26-20(17)25-16-8-12(22)3-5-14(16)21(26)29/h3-10,24H,2H2,1H3,(H,27,28)/p+1