2-chloranylpropyl 4-methylbenzenesulfonate

Systemtic Name: 2-chloranylpropyl 4-methylbenzenesulfonate Openeye Name: 2-chloropropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-chloropropyl ester IUPAC Name: 2-chloropropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-chloropropyl ester Formula: C10H13ClO3S MolecularWeight: 248.72642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)Cl

InChI

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