(4-methylphenyl)methyl 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: (4-methylphenyl)methyl 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: p-tolylmethyl 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid (4-methylbenzyl) ester Formula: C16H15ClO4S MolecularWeight: 338.8059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClO4S/c1-11-3-5-12(6-4-11)10-21-16(18)13-7-8-14(17)15(9-13)22(2,19)20/h3-9H,10H2,1-2H3