4-[3-(4-methylphenyl)sulfonylpropoxy]-2-phenylmethoxy-benzoic acid

Systemtic Name: 4-[3-(4-methylphenyl)sulfonylpropoxy]-2-phenylmethoxy-benzoic acid Openeye Name: 2-benzyloxy-4-[3-(p-tolylsulfonyl)propoxy]benzoic acid CAS Name: 4-[3-(4-methylphenyl)sulfonylpropoxy]-2-phenylmethoxybenzoic acid IUPAC Name: 4-[3-(4-methylphenyl)sulfonylpropoxy]-2-phenylmethoxybenzoic acid Traditional Name: 2-benzoxy-4-(3-tosylpropoxy)benzoic acid Formula: C24H24O6S MolecularWeight: 440.50876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H24O6S/c1-18-8-11-21(12-9-18)31(27,28)15-5-14-29-20-10-13-22(24(25)26)23(16-20)30-17-19-6-3-2-4-7-19/h2-4,6-13,16H,5,14-15,17H2,1H3,(H,25,26)