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

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 4-ethoxybenzenesulfonate Openeye Name: [3-(tetrazol-1-yl)phenyl] 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O4S/c1-2-22-13-6-8-15(9-7-13)24(20,21)23-14-5-3-4-12(10-14)19-11-16-17-18-19/h3-11H,2H2,1H3