(2,4-dimethylpiperazin-1-yl) 6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxylate

Systemtic Name: (2,4-dimethylpiperazin-1-yl) 6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxylate Openeye Name: (2,4-dimethylpiperazin-1-yl) 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylate CAS Name: 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylic acid (2,4-dimethyl-1-piperazinyl) ester IUPAC Name: (2,4-dimethylpiperazin-1-yl) 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylate Traditional Name: 6-keto-5H-benzo[b][1,4]benzodiazepine-11-carboxylic acid (2,4-dimethylpiperazino) ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1OC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42)C

Isomeric SMILES

CC1CN(CCN1OC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42)C

InChI

InChI=1S/C20H22N4O3/c1-14-13-22(2)11-12-23(14)27-20(26)24-17-9-5-3-7-15(17)19(25)21-16-8-4-6-10-18(16)24/h3-10,14H,11-13H2,1-2H3,(H,21,25)