(7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethyl-azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethyl-azanium Openeye Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethyl-ammonium CAS Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethylammonium IUPAC Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethylazanium Traditional Name: (7-chloro-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-diethyl-ammonium Formula: C13H18ClN3O+2 MolecularWeight: 267.75452

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Cl

Isomeric SMILES

CC[NH+](CC)CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Cl

InChI

InChI=1S/C13H16ClN3O/c1-3-16(4-2)9-11-7-13(18)17-8-10(14)5-6-12(17)15-11/h5-8H,3-4,9H2,1-2H3/p+2