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(2,3,6-trimethylphenyl) 4-(methylsulfonylmethyl)benzoate

(2,3,6-trimethylphenyl) 4-(methylsulfonylmethyl)benzoate

Systemtic Name:(2,3,6-trimethylphenyl) 4-(methylsulfonylmethyl)benzoate
Openeye Name:(2,3,6-trimethylphenyl) 4-(methylsulfonylmethyl)benzoate
CAS Name:4-(methylsulfonylmethyl)benzoic acid (2,3,6-trimethylphenyl) ester
IUPAC Name:(2,3,6-trimethylphenyl) 4-(methylsulfonylmethyl)benzoate
Traditional Name:4-(mesylmethyl)benzoic acid (2,3,6-trimethylphenyl) ester
Formula: C18H20O4S
MolecularWeight: 332.414
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C


Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C


InChI

InChI=1S/C18H20O4S/c1-12-5-6-13(2)17(14(12)3)22-18(19)16-9-7-15(8-10-16)11-23(4,20)21/h5-10H,11H2,1-4H3


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