methyl 4-oxidanylidene-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylate

Systemtic Name: methyl 4-oxidanylidene-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylate Openeye Name: methyl 4-oxo-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylate CAS Name: 4-oxo-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylate Traditional Name: 4-keto-5,10-dihydropyrazolo[5,1-c][1,4]benzodiazepine-2-carboxylic acid methyl ester Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN2CC3=CC=CC=C3NC(=O)C2=C1

Isomeric SMILES

COC(=O)C1=NN2CC3=CC=CC=C3NC(=O)C2=C1

InChI

InChI=1S/C13H11N3O3/c1-19-13(18)10-6-11-12(17)14-9-5-3-2-4-8(9)7-16(11)15-10/h2-6H,7H2,1H3,(H,14,17)