ethyl 4-chloranyl-1-ethyl-2,6-dimethyl-7-oxidanylidene-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylate

Systemtic Name: ethyl 4-chloranyl-1-ethyl-2,6-dimethyl-7-oxidanylidene-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylate Openeye Name: ethyl 4-chloro-1-ethyl-2,6-dimethyl-7-oxo-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylate CAS Name: 4-chloro-1-ethyl-2,6-dimethyl-7-oxo-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-1-ethyl-2,6-dimethyl-7-oxo-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylate Traditional Name: 4-chloro-1-ethyl-7-keto-2,6-dimethyl-2,8-dihydropyrimido[5,4-b][1,4]oxazin-1-ium-1-carboxylic acid ethyl ester Formula: C13H19ClN3O4+ MolecularWeight: 316.76066

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(N=C(C2=C1NC(=O)C(O2)C)Cl)C)C(=O)OCC

Isomeric SMILES

CC[N+]1(C(N=C(C2=C1NC(=O)C(O2)C)Cl)C)C(=O)OCC

InChI

InChI=1S/C13H18ClN3O4/c1-5-17(13(19)20-6-2)8(4)15-10(14)9-11(17)16-12(18)7(3)21-9/h7-8H,5-6H2,1-4H3/p+1