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

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] (4-fluorophenyl)methanesulfonate Openeye Name: [3-(tetrazol-1-yl)phenyl] (4-fluorophenyl)methanesulfonate CAS Name: (4-fluorophenyl)methanesulfonic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] (4-fluorophenyl)methanesulfonate Traditional Name: (4-fluorophenyl)methanesulfonic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C14H11FN4O3S MolecularWeight: 334.325543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OS(=O)(=O)CC2=CC=C(C=C2)F)N3C=NN=N3

Isomeric SMILES

C1=CC(=CC(=C1)OS(=O)(=O)CC2=CC=C(C=C2)F)N3C=NN=N3

InChI

InChI=1S/C14H11FN4O3S/c15-12-6-4-11(5-7-12)9-23(20,21)22-14-3-1-2-13(8-14)19-10-16-17-18-19/h1-8,10H,9H2