2-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-propanoic acid

Systemtic Name: 2-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-propanoic acid Openeye Name: 2-oxo-3-(4-phenoxyphenyl)sulfanyl-propanoic acid CAS Name: 2-oxo-3-[(4-phenoxyphenyl)thio]propanoic acid IUPAC Name: 2-oxo-3-(4-phenoxyphenyl)sulfanylpropanoic acid Traditional Name: 2-keto-3-[(4-phenoxyphenyl)thio]propionic acid Formula: C15H12O4S MolecularWeight: 288.31838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)SCC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)SCC(=O)C(=O)O

InChI

InChI=1S/C15H12O4S/c16-14(15(17)18)10-20-13-8-6-12(7-9-13)19-11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18)