N-(4-iodophenyl)-7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-(4-iodophenyl)-7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-(4-iodophenyl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-(4-iodophenyl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-(4-iodophenyl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-(4-iodophenyl)-4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C16H13IN3O2+ MolecularWeight: 406.19779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC=C(C2=O)C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC=C(C2=O)C(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C16H12IN3O2/c1-10-2-7-14-18-8-13(16(22)20(14)9-10)15(21)19-12-5-3-11(17)4-6-12/h2-9H,1H3,(H,19,21)/p+1