[4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] benzenesulfonate

Systemtic Name: [4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] benzenesulfonate Openeye Name: [4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] ester IUPAC Name: [4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(E)-1H-1,2,4-triazol-5-yliminomethyl]phenyl] ester Formula: C15H12N4O3S MolecularWeight: 328.34578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/C3=NC=NN3

InChI

InChI=1S/C15H12N4O3S/c20-23(21,14-4-2-1-3-5-14)22-13-8-6-12(7-9-13)10-16-15-17-11-18-19-15/h1-11H,(H,17,18,19)/b16-10+