7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-dione

Systemtic Name: 7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-dione Openeye Name: 7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-dione CAS Name: 7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-dione IUPAC Name: 7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-dione Traditional Name: 7-(4-bromophenyl)-9,10-dimethoxy-2,12-dihydro-[1,2,4]triazino[4,3-c][2,3]benzodiazepine-3,4-quinone Formula: C19H15BrN4O4 MolecularWeight: 443.2508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC3=NNC(=O)C(=O)N3N=C2C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC3=NNC(=O)C(=O)N3N=C2C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C19H15BrN4O4/c1-27-14-7-11-8-16-21-22-18(25)19(26)24(16)23-17(13(11)9-15(14)28-2)10-3-5-12(20)6-4-10/h3-7,9H,8H2,1-2H3,(H,22,25)