(4-chloranyl-3-methyl-phenyl) 2,3,4-trimethylbenzenesulfonate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 2,3,4-trimethylbenzenesulfonate Openeye Name: (4-chloro-3-methyl-phenyl) 2,3,4-trimethylbenzenesulfonate CAS Name: 2,3,4-trimethylbenzenesulfonic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 2,3,4-trimethylbenzenesulfonate Traditional Name: 2,3,4-trimethylbenzenesulfonic acid (4-chloro-3-methyl-phenyl) ester Formula: C16H17ClO3S MolecularWeight: 324.82238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)Cl)C)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)Cl)C)C)C

InChI

InChI=1S/C16H17ClO3S/c1-10-5-8-16(13(4)12(10)3)21(18,19)20-14-6-7-15(17)11(2)9-14/h5-9H,1-4H3