N-(1,3-benzodioxol-5-yl)-8-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-8-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-keto-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C17H14N3O4+ MolecularWeight: 324.31076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C(=O)C(=CN2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC2=[N+](C=C1)C(=O)C(=CN2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H13N3O4/c1-10-4-5-20-15(6-10)18-8-12(17(20)22)16(21)19-11-2-3-13-14(7-11)24-9-23-13/h2-8H,9H2,1H3,(H,19,21)/p+1