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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylene(1,2,4-triazol-4-yl)amine Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)C=NN3C=NN=C3

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)/C=N/N3C=NN=C3

InChI

InChI=1S/C12H12N4O2/c1-3-10(7-15-16-8-13-14-9-16)12-11(4-1)17-5-2-6-18-12/h1,3-4,7-9H,2,5-6H2/b15-7+