ethyl 3-aminocarbonyl-7-methyl-6-oxidanylidene-pyrazolo[1,5-a][1,3]diazepine-8-carboxylate

Systemtic Name: ethyl 3-aminocarbonyl-7-methyl-6-oxidanylidene-pyrazolo[1,5-a][1,3]diazepine-8-carboxylate Openeye Name: ethyl 3-carbamoyl-7-methyl-6-oxo-pyrazolo[1,5-a][1,3]diazepine-8-carboxylate CAS Name: 3-carbamoyl-7-methyl-6-oxo-8-pyrazolo[1,5-a][1,3]diazepinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-carbamoyl-7-methyl-6-oxopyrazolo[1,5-a][1,3]diazepine-8-carboxylate Traditional Name: 3-carbamoyl-6-keto-7-methyl-pyrazolo[1,5-a][1,3]diazepine-8-carboxylic acid ethyl ester Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C=NC2=C(C=NN12)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C=NC2=C(C=NN12)C(=O)N)C

InChI

InChI=1S/C12H12N4O4/c1-3-20-12(19)9-6(2)8(17)5-14-11-7(10(13)18)4-15-16(9)11/h4-5H,3H2,1-2H3,(H2,13,18)