[5-bromanyl-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ethanoate

Systemtic Name: [5-bromanyl-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ethanoate Openeye Name: [5-bromo-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] acetate CAS Name: acetic acid [5-bromo-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ester IUPAC Name: [5-bromo-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] acetate Traditional Name: acetic acid [5-bromo-2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ester Formula: C12H11BrN4O3 MolecularWeight: 339.14474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrN4O3/c1-8(18)20-12-4-10(13)9(3-11(12)19-2)5-16-17-6-14-15-7-17/h3-7H,1-2H3/b16-5+