(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-methylsulfonylbenzoate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-methylsulfonylbenzoate Openeye Name: (1-phenyltetrazol-5-yl)methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O4S/c1-25(22,23)14-10-6-5-9-13(14)16(21)24-11-15-17-18-19-20(15)12-7-3-2-4-8-12/h2-10H,11H2,1H3