(4-ethylphenyl) 4-chloranyl-3-methylsulfonyl-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C16H15ClO4S/c1-3-11-4-7-13(8-5-11)21-16(18)12-6-9-14(17)15(10-12)22(2,19)20/h4-10H,3H2,1-2H3