ethyl 3-bromanyl-7-methyl-2-oxidanylidene-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylate

Systemtic Name: ethyl 3-bromanyl-7-methyl-2-oxidanylidene-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylate Openeye Name: ethyl 3-bromo-7-methyl-2-oxo-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylate CAS Name: 3-bromo-7-methyl-2-oxo-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-7-methyl-2-oxo-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylate Traditional Name: 3-bromo-2-keto-7-methyl-1,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium-6-carboxylic acid ethyl ester Formula: C10H11BrN3O3+ MolecularWeight: 301.11664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(C(=O)N[N+]2=C1C)Br

Isomeric SMILES

CCOC(=O)C1=CN=C2C(C(=O)N[N+]2=C1C)Br

InChI

InChI=1S/C10H10BrN3O3/c1-3-17-10(16)6-4-12-8-7(11)9(15)13-14(8)5(6)2/h4,7H,3H2,1-2H3/p+1