[3-(1,2,3,4-tetrazol-1-yl)phenyl] 3,4-diethoxybenzenesulfonate

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 3,4-diethoxybenzenesulfonate Openeye Name: [3-(tetrazol-1-yl)phenyl] 3,4-diethoxybenzenesulfonate CAS Name: 3,4-diethoxybenzenesulfonic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 3,4-diethoxybenzenesulfonate Traditional Name: 3,4-diethoxybenzenesulfonic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3)OCC

InChI

InChI=1S/C17H18N4O5S/c1-3-24-16-9-8-15(11-17(16)25-4-2)27(22,23)26-14-7-5-6-13(10-14)21-12-18-19-20-21/h5-12H,3-4H2,1-2H3