2-(phenylmethyl)-3-(phenylsulfonyl)propanoic acid

Systemtic Name: 2-(phenylmethyl)-3-(phenylsulfonyl)propanoic acid Openeye Name: 2-(benzenesulfonylmethyl)-3-phenyl-propanoic acid CAS Name: 2-(benzenesulfonylmethyl)-3-phenylpropanoic acid IUPAC Name: 2-(benzenesulfonylmethyl)-3-phenylpropanoic acid Traditional Name: 2-benzyl-3-besyl-propionic acid Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4S/c17-16(18)14(11-13-7-3-1-4-8-13)12-21(19,20)15-9-5-2-6-10-15/h1-10,14H,11-12H2,(H,17,18)