[4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 3-fluoranyl-4-methoxy-benzenesulfonate Openeye Name: [4-(tetrazol-1-yl)phenyl] 3-fluoro-4-methoxy-benzenesulfonate CAS Name: 3-fluoro-4-methoxybenzenesulfonic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 3-fluoro-4-methoxybenzenesulfonate Traditional Name: 3-fluoro-4-methoxy-benzenesulfonic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C14H11FN4O4S MolecularWeight: 350.324943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N3C=NN=N3)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N3C=NN=N3)F

InChI

InChI=1S/C14H11FN4O4S/c1-22-14-7-6-12(8-13(14)15)24(20,21)23-11-4-2-10(3-5-11)19-9-16-17-18-19/h2-9H,1H3