methyl 8-chloranyl-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate

Systemtic Name: methyl 8-chloranyl-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate Openeye Name: methyl 8-chloro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate CAS Name: 8-chloro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 8-chloro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate Traditional Name: 8-chloro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylic acid methyl ester Formula: C19H14ClN3O2 MolecularWeight: 351.78636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN2C(=C1)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN2C(=C1)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H14ClN3O2/c1-25-19(24)16-10-14-11-21-18(12-5-3-2-4-6-12)15-9-13(20)7-8-17(15)23(14)22-16/h2-10H,11H2,1H3