ethyl (4S)-4-(2-chloranyl-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(2-chloranyl-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(2-chloro-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2-chloro-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(2-chloro-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2-chloro-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H18ClN4O4+ MolecularWeight: 377.80222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=C(NC3=C(C=CC=[N+]3C2=O)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=C(NC3=C(C=CC=[N+]3C2=O)C)Cl)C

InChI

InChI=1S/C17H17ClN4O4/c1-4-26-16(24)10-9(3)19-17(25)20-12(10)11-13(18)21-14-8(2)6-5-7-22(14)15(11)23/h5-7,12H,4H2,1-3H3,(H2,19,20,24,25)/p+1/t12-/m0/s1