[2-methoxy-5-[(4-methoxy-3-sulfamoyloxy-phenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate

Systemtic Name: [2-methoxy-5-[(4-methoxy-3-sulfamoyloxy-phenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate Openeye Name: [2-methoxy-5-[(4-methoxy-3-sulfamoyloxy-phenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate CAS Name: sulfamic acid [2-methoxy-5-[(4-methoxy-3-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[(4-methoxy-3-sulfamoyloxyphenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [2-methoxy-5-[(4-methoxy-3-sulfamoyloxy-phenyl)-(1,2,4-triazol-1-yl)methyl]phenyl] ester Formula: C17H19N5O8S2 MolecularWeight: 485.49146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)OC)OS(=O)(=O)N)N3C=NC=N3)OS(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)OC)OS(=O)(=O)N)N3C=NC=N3)OS(=O)(=O)N

InChI

InChI=1S/C17H19N5O8S2/c1-27-13-5-3-11(7-15(13)29-31(18,23)24)17(22-10-20-9-21-22)12-4-6-14(28-2)16(8-12)30-32(19,25)26/h3-10,17H,1-2H3,(H2,18,23,24)(H2,19,25,26)