2-[[(4-chloranyl-2-fluoranyl-phenyl)amino]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[(4-chloranyl-2-fluoranyl-phenyl)amino]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-chloro-2-fluoro-anilino)methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-chloro-2-fluoroanilino)methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-chloro-2-fluoroanilino)methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-chloro-2-fluoro-anilino)methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H14ClFN3O+ MolecularWeight: 318.753263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C16H13ClFN3O/c1-10-3-2-6-21-15(22)8-12(20-16(10)21)9-19-14-5-4-11(17)7-13(14)18/h2-8,19H,9H2,1H3/p+1