1-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (Z)-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylene-(1,2,4-triazol-4-yl)amine Formula: C12H11ClN4O2 MolecularWeight: 278.69434

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C=NN3C=NN=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)/C=N\N3C=NN=C3)Cl)OC1

InChI

InChI=1S/C12H11ClN4O2/c13-10-4-9(6-16-17-7-14-15-8-17)5-11-12(10)19-3-1-2-18-11/h4-8H,1-3H2/b16-6-