[4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate

Systemtic Name: [4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate Openeye Name: [4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] ester IUPAC Name: [4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[(4-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] ester Formula: C15H15N5O6S2 MolecularWeight: 425.4395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)OS(=O)(=O)N)N3C=NC=N3)OS(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)OS(=O)(=O)N)N3C=NC=N3)OS(=O)(=O)N

InChI

InChI=1S/C15H15N5O6S2/c16-27(21,22)25-13-5-1-11(2-6-13)15(20-10-18-9-19-20)12-3-7-14(8-4-12)26-28(17,23)24/h1-10,15H,(H2,16,21,22)(H2,17,23,24)