[2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 2-nitrobenzenesulfonate

Systemtic Name: [2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 2-nitrobenzenesulfonate Openeye Name: [2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid [2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] ester IUPAC Name: [2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid [2-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] ester Formula: C15H11N5O5S MolecularWeight: 373.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NN2C=NN=C2)OS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N\N2C=NN=C2)OS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O5S/c21-20(22)13-6-2-4-8-15(13)26(23,24)25-14-7-3-1-5-12(14)9-18-19-10-16-17-11-19/h1-11H/b18-9-