(4-chloranyl-3-methyl-phenyl) 2,4,5-trimethylbenzenesulfonate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 2,4,5-trimethylbenzenesulfonate Openeye Name: (4-chloro-3-methyl-phenyl) 2,4,5-trimethylbenzenesulfonate CAS Name: 2,4,5-trimethylbenzenesulfonic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 2,4,5-trimethylbenzenesulfonate Traditional Name: 2,4,5-trimethylbenzenesulfonic acid (4-chloro-3-methyl-phenyl) ester Formula: C16H17ClO3S MolecularWeight: 324.82238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)OC2=CC(=C(C=C2)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)OC2=CC(=C(C=C2)Cl)C)C

InChI

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