2-(2,3-diacetyloxypropylsulfonylmethyl)-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 2-(2,3-diacetyloxypropylsulfonylmethyl)-3-naphthalen-1-yl-propanoic acid Openeye Name: 2-(2,3-diacetoxypropylsulfonylmethyl)-3-(1-naphthyl)propanoic acid CAS Name: 2-(2,3-diacetyloxypropylsulfonylmethyl)-3-(1-naphthalenyl)propanoic acid IUPAC Name: 2-(2,3-diacetyloxypropylsulfonylmethyl)-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-(2,3-diacetoxypropylsulfonylmethyl)-3-(1-naphthyl)propionic acid Formula: C21H24O8S MolecularWeight: 436.47546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CS(=O)(=O)CC(CC1=CC=CC2=CC=CC=C21)C(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CS(=O)(=O)CC(CC1=CC=CC2=CC=CC=C21)C(=O)O)OC(=O)C

InChI

InChI=1S/C21H24O8S/c1-14(22)28-11-19(29-15(2)23)13-30(26,27)12-18(21(24)25)10-17-8-5-7-16-6-3-4-9-20(16)17/h3-9,18-19H,10-13H2,1-2H3,(H,24,25)