4-chloranyl-N-(2,8-dimethyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2,8-dimethyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(2,8-dimethyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-(2,8-dimethyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2,8-dimethyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(4-keto-2,8-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-3-nitro-benzamide Formula: C17H14ClN4O4+ MolecularWeight: 373.77046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C(=O)C(=C(N2)C)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=[N+](C=C1)C(=O)C(=C(N2)C)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN4O4/c1-9-5-6-21-14(7-9)19-10(2)15(17(21)24)20-16(23)11-3-4-12(18)13(8-11)22(25)26/h3-8H,1-2H3,(H,20,23)/p+1