5-[(9-methyl-4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(9-methyl-4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(9-methyl-4-oxo-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[9-methyl-4-oxo-2-(1-pyrrolidinyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(9-methyl-4-oxo-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(4-keto-9-methyl-2-pyrrolidino-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene]barbituric acid Formula: C18H18N5O4+ MolecularWeight: 368.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C3C(=O)NC(=O)NC3=O)N4CCCC4

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C3C(=O)NC(=O)NC3=O)N4CCCC4

InChI

InChI=1S/C18H17N5O4/c1-10-5-4-8-23-13(10)19-14(22-6-2-3-7-22)11(17(23)26)9-12-15(24)20-18(27)21-16(12)25/h4-5,8-9H,2-3,6-7H2,1H3,(H2,20,21,24,25,27)/p+1