methyl 4-imidazol-1-yl-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-imidazol-1-yl-2-methyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-imidazol-1-yl-2-methyl-5-methylsulfonyl-benzoate CAS Name: 4-(1-imidazolyl)-2-methyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-imidazol-1-yl-2-methyl-5-methylsulfonylbenzoate Traditional Name: 4-imidazol-1-yl-5-mesyl-2-methyl-benzoic acid methyl ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CN=C2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CN=C2

InChI

InChI=1S/C13H14N2O4S/c1-9-6-11(15-5-4-14-8-15)12(20(3,17)18)7-10(9)13(16)19-2/h4-8H,1-3H3