1-(5-bromanyl-2-propan-2-yloxy-phenyl)-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(5-bromanyl-2-propan-2-yloxy-phenyl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(5-bromo-2-isopropoxy-phenyl)-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-(5-bromo-2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(5-bromo-2-propan-2-yloxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-(5-bromo-2-isopropoxy-benzylidene)-(1,2,4-triazol-4-yl)amine Formula: C12H13BrN4O MolecularWeight: 309.16182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)C=NN2C=NN=C2

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)/C=N/N2C=NN=C2

InChI

InChI=1S/C12H13BrN4O/c1-9(2)18-12-4-3-11(13)5-10(12)6-16-17-7-14-15-8-17/h3-9H,1-2H3/b16-6+