1-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[3-(1-benzotriazolylmethyl)-4-methoxyphenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[3-(benzotriazol-1-ylmethyl)-4-methoxyphenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-[3-(benzotriazol-1-ylmethyl)-4-methoxy-benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C17H15N7O MolecularWeight: 333.3473

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2C=NN=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/N2C=NN=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H15N7O/c1-25-17-7-6-13(9-20-23-11-18-19-12-23)8-14(17)10-24-16-5-3-2-4-15(16)21-22-24/h2-9,11-12H,10H2,1H3/b20-9+