3-(1-chloranylpropan-2-yl)-4-methyl-benzenesulfonate

Systemtic Name: 3-(1-chloranylpropan-2-yl)-4-methyl-benzenesulfonate Openeye Name: 3-(2-chloro-1-methyl-ethyl)-4-methyl-benzenesulfonate CAS Name: 3-(1-chloropropan-2-yl)-4-methylbenzenesulfonate IUPAC Name: 3-(1-chloropropan-2-yl)-4-methylbenzenesulfonate Traditional Name: 3-(2-chloro-1-methyl-ethyl)-4-methyl-besylate Formula: C10H12ClO3S- MolecularWeight: 247.71848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)[O-])C(C)CCl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)[O-])C(C)CCl

InChI

InChI=1S/C10H13ClO3S/c1-7-3-4-9(15(12,13)14)5-10(7)8(2)6-11/h3-5,8H,6H2,1-2H3,(H,12,13,14)/p-1