1-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)methanimine

Systemtic Name: 1-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)methanimine Openeye Name: 1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-N-(1H-1,2,4-triazol-5-yl)methanimine CAS Name: 1-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)methanimine IUPAC Name: 1-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)methanimine Traditional Name: (E)-(4-benzoxy-3-bromo-5-methoxy-benzylidene)-(1H-1,2,4-triazol-5-yl)amine Formula: C17H15BrN4O2 MolecularWeight: 387.2306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NC2=NC=NN2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/C2=NC=NN2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C17H15BrN4O2/c1-23-15-8-13(9-19-17-20-11-21-22-17)7-14(18)16(15)24-10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H,20,21,22)/b19-9+