3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1,2,3-benzotriazin-4-one Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CN3C(=O)C4=CC=CC=C4N=N3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CN3C(=O)C4=CC=CC=C4N=N3)Cl)OC1

InChI

InChI=1S/C17H14ClN3O3/c18-13-8-11(9-15-16(13)24-7-3-6-23-15)10-21-17(22)12-4-1-2-5-14(12)19-20-21/h1-2,4-5,8-9H,3,6-7,10H2