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

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 4-chloranylbenzenesulfonate Openeye Name: [3-(tetrazol-1-yl)phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C13H9ClN4O3S MolecularWeight: 336.75356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)Cl)N3C=NN=N3

Isomeric SMILES

C1=CC(=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)Cl)N3C=NN=N3

InChI

InChI=1S/C13H9ClN4O3S/c14-10-4-6-13(7-5-10)22(19,20)21-12-3-1-2-11(8-12)18-9-15-16-17-18/h1-9H