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

Systemtic Name: [2-methoxy-4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-methoxy-4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl] ester Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NN3C=NN=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=N\N3C=NN=C3)OC

InChI

InChI=1S/C17H16N4O4S/c1-13-3-6-15(7-4-13)26(22,23)25-16-8-5-14(9-17(16)24-2)10-20-21-11-18-19-12-21/h3-12H,1-2H3/b20-10-