N-(2,1,3-benzoxadiazol-4-yl)-7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: N-(2,1,3-benzoxadiazol-4-yl)-7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: N-(2,1,3-benzoxadiazol-4-yl)-7-bromo-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: N-(2,1,3-benzoxadiazol-4-yl)-7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: N-(2,1,3-benzoxadiazol-4-yl)-7-bromo-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: N-benzofurazan-4-yl-7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C16H12BrN3O4 MolecularWeight: 390.18818

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(=O)NC3=CC=CC4=NON=C43)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(=O)NC3=CC=CC4=NON=C43)Br)OC1

InChI

InChI=1S/C16H12BrN3O4/c17-10-8-14-13(22-5-2-6-23-14)7-9(10)16(21)18-11-3-1-4-12-15(11)20-24-19-12/h1,3-4,7-8H,2,5-6H2,(H,18,21)