2-methyl-5-methylsulfonyl-4-phenylmethoxy-benzoic acid

Systemtic Name: 2-methyl-5-methylsulfonyl-4-phenylmethoxy-benzoic acid Openeye Name: 4-benzyloxy-2-methyl-5-methylsulfonyl-benzoic acid CAS Name: 2-methyl-5-methylsulfonyl-4-phenylmethoxybenzoic acid IUPAC Name: 2-methyl-5-methylsulfonyl-4-phenylmethoxybenzoic acid Traditional Name: 4-benzoxy-5-mesyl-2-methyl-benzoic acid Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C16H16O5S/c1-11-8-14(21-10-12-6-4-3-5-7-12)15(22(2,19)20)9-13(11)16(17)18/h3-9H,10H2,1-2H3,(H,17,18)