methyl 2-chloranyl-5-methylsulfonyl-3-(1-oxidanylpropan-2-yl)benzoate

Systemtic Name: methyl 2-chloranyl-5-methylsulfonyl-3-(1-oxidanylpropan-2-yl)benzoate Openeye Name: methyl 2-chloro-3-(2-hydroxy-1-methyl-ethyl)-5-methylsulfonyl-benzoate CAS Name: 2-chloro-3-(1-hydroxypropan-2-yl)-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-chloro-3-(1-hydroxypropan-2-yl)-5-methylsulfonylbenzoate Traditional Name: 2-chloro-3-(2-hydroxy-1-methyl-ethyl)-5-mesyl-benzoic acid methyl ester Formula: C12H15ClO5S MolecularWeight: 306.7625

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C1=C(C(=CC(=C1)S(=O)(=O)C)C(=O)OC)Cl

Isomeric SMILES

CC(CO)C1=C(C(=CC(=C1)S(=O)(=O)C)C(=O)OC)Cl

InChI

InChI=1S/C12H15ClO5S/c1-7(6-14)9-4-8(19(3,16)17)5-10(11(9)13)12(15)18-2/h4-5,7,14H,6H2,1-3H3