[2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-chloranylbenzoate Openeye Name: [2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl] ester Formula: C17H13ClN4O3 MolecularWeight: 356.76312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2C=NN=C2)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/N2C=NN=C2)OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN4O3/c1-24-16-8-12(9-21-22-10-19-20-11-22)2-7-15(16)25-17(23)13-3-5-14(18)6-4-13/h2-11H,1H3/b21-9+