2-[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-4-yl]ethyl methanesulfonate

Systemtic Name: 2-[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-4-yl]ethyl methanesulfonate Openeye Name: 2-[1-(4-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[1-(4-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]ethyl ester IUPAC Name: 2-[1-(4-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[5-keto-1-(4-methoxyphenyl)-3-methyl-1,2,4-triazol-4-yl]ethyl ester Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1CCOS(=O)(=O)C)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=NN(C(=O)N1CCOS(=O)(=O)C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H17N3O5S/c1-10-14-16(11-4-6-12(20-2)7-5-11)13(17)15(10)8-9-21-22(3,18)19/h4-7H,8-9H2,1-3H3