methyl 2-chloranyl-3-(5-methyl-1,4,2-dioxazol-3-yl)-4-methylsulfonyl-benzoate

Systemtic Name: methyl 2-chloranyl-3-(5-methyl-1,4,2-dioxazol-3-yl)-4-methylsulfonyl-benzoate Openeye Name: methyl 2-chloro-3-(5-methyl-1,4,2-dioxazol-3-yl)-4-methylsulfonyl-benzoate CAS Name: 2-chloro-3-(5-methyl-1,4,2-dioxazol-3-yl)-4-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-chloro-3-(5-methyl-1,4,2-dioxazol-3-yl)-4-methylsulfonylbenzoate Traditional Name: 2-chloro-4-mesyl-3-(5-methyl-1,4,2-dioxazol-3-yl)benzoic acid methyl ester Formula: C12H12ClNO6S MolecularWeight: 333.74478

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Descriptors Computed from Structure

Canonical SMILES:

CC1OC(=NO1)C2=C(C=CC(=C2Cl)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CC1OC(=NO1)C2=C(C=CC(=C2Cl)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C12H12ClNO6S/c1-6-19-11(14-20-6)9-8(21(3,16)17)5-4-7(10(9)13)12(15)18-2/h4-6H,1-3H3