N-[[4-(4-fluoranylphenoxy)phenyl]methyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-[[4-(4-fluoranylphenoxy)phenyl]methyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-[[4-(4-fluorophenoxy)phenyl]methyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-[[4-(4-fluorophenoxy)phenyl]methyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-[[4-(4-fluorophenoxy)phenyl]methyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-[4-(4-fluorophenoxy)benzyl]-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C22H17FN3O3+ MolecularWeight: 390.387083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C22H16FN3O3/c23-16-6-10-18(11-7-16)29-17-8-4-15(5-9-17)13-25-21(27)19-14-24-20-3-1-2-12-26(20)22(19)28/h1-12,14H,13H2,(H,25,27)/p+1