N-(7-chloranyl-2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propyl-pentanamide

Systemtic Name: N-(7-chloranyl-2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propyl-pentanamide Openeye Name: N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propyl-pentanamide CAS Name: N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propylpentanamide IUPAC Name: N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propylpentanamide Traditional Name: N-(7-chloro-4-keto-2-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-propyl-valeramide Formula: C17H23ClN3O2+ MolecularWeight: 336.83642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=C(NC2=[N+](C1=O)C=C(C=C2)Cl)C

Isomeric SMILES

CCCC(CCC)C(=O)NC1=C(NC2=[N+](C1=O)C=C(C=C2)Cl)C

InChI

InChI=1S/C17H22ClN3O2/c1-4-6-12(7-5-2)16(22)20-15-11(3)19-14-9-8-13(18)10-21(14)17(15)23/h8-10,12H,4-7H2,1-3H3,(H,20,22)/p+1