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

Systemtic Name: (2S)-N-(7-chloranyl-2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-phenyl-butanamide Openeye Name: (2S)-N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-phenyl-butanamide CAS Name: (2S)-N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-phenylbutanamide IUPAC Name: (2S)-N-(7-chloro-2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-phenylbutanamide Traditional Name: (2S)-N-(7-chloro-4-keto-2-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-phenyl-butyramide Formula: C19H19ClN3O2+ MolecularWeight: 356.82606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=[N+](C2=O)C=C(C=C3)Cl)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC2=C(NC3=[N+](C2=O)C=C(C=C3)Cl)C

InChI

InChI=1S/C19H18ClN3O2/c1-3-15(13-7-5-4-6-8-13)18(24)22-17-12(2)21-16-10-9-14(20)11-23(16)19(17)25/h4-11,15H,3H2,1-2H3,(H,22,24)/p+1/t15-/m0/s1