1-(4-chloranylphenoxy)propan-2-yl 4-methylbenzenesulfonate

Systemtic Name: 1-(4-chloranylphenoxy)propan-2-yl 4-methylbenzenesulfonate Openeye Name: [2-(4-chlorophenoxy)-1-methyl-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-(4-chlorophenoxy)propan-2-yl ester IUPAC Name: 1-(4-chlorophenoxy)propan-2-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-chlorophenoxy)-1-methyl-ethyl] ester Formula: C16H17ClO4S MolecularWeight: 340.82178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClO4S/c1-12-3-9-16(10-4-12)22(18,19)21-13(2)11-20-15-7-5-14(17)6-8-15/h3-10,13H,11H2,1-2H3