methyl 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylate

Systemtic Name: methyl 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylate Openeye Name: methyl 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylate CAS Name: 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylate Traditional Name: 5-(2-chlorophenyl)-4,6-dihydro-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-8-carboxylic acid methyl ester Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N3C=NN=C3CN(C2)C4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N3C=NN=C3CN(C2)C4=CC=CC=C4Cl

InChI

InChI=1S/C18H15ClN4O2/c1-25-18(24)12-6-7-15-13(8-12)9-22(10-17-21-20-11-23(15)17)16-5-3-2-4-14(16)19/h2-8,11H,9-10H2,1H3