3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-dione

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-dione Openeye Name: 3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-dione CAS Name: 3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-dione IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-dione Traditional Name: 3-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1H-benzo[i][1,4]benzodiazepine-2,5-quinone Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2NC(=O)C(NC3=O)CC4=CN=CN4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2NC(=O)C(NC3=O)CC4=CN=CN4

InChI

InChI=1S/C17H14N4O2/c22-16-13-6-5-10-3-1-2-4-12(10)15(13)21-17(23)14(20-16)7-11-8-18-9-19-11/h1-6,8-9,14H,7H2,(H,18,19)(H,20,22)(H,21,23)