(2-methoxy-2-oxidanylidene-ethyl) 4-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 4-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 4-(5-methylsulfanyltetrazol-1-yl)benzoate CAS Name: 4-[5-(methylthio)-1-tetrazolyl]benzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 4-(5-methylsulfanyltetrazol-1-yl)benzoate Traditional Name: 4-[5-(methylthio)tetrazol-1-yl]benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC(=O)C1=CC=C(C=C1)N2C(=NN=N2)SC

Isomeric SMILES

COC(=O)COC(=O)C1=CC=C(C=C1)N2C(=NN=N2)SC

InChI

InChI=1S/C12H12N4O4S/c1-19-10(17)7-20-11(18)8-3-5-9(6-4-8)16-12(21-2)13-14-15-16/h3-6H,7H2,1-2H3