3-(2-methylphenoxy)-3-oxidanylidene-2-thiophen-3-yl-propanoic acid

Systemtic Name: 3-(2-methylphenoxy)-3-oxidanylidene-2-thiophen-3-yl-propanoic acid Openeye Name: 3-(2-methylphenoxy)-3-oxo-2-(3-thienyl)propanoic acid CAS Name: 3-(2-methylphenoxy)-3-oxo-2-(3-thiophenyl)propanoic acid IUPAC Name: 3-(2-methylphenoxy)-3-oxo-2-thiophen-3-ylpropanoic acid Traditional Name: 3-keto-3-(2-methylphenoxy)-2-(3-thienyl)propionic acid Formula: C14H12O4S MolecularWeight: 276.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)C(C2=CSC=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OC(=O)C(C2=CSC=C2)C(=O)O

InChI

InChI=1S/C14H12O4S/c1-9-4-2-3-5-11(9)18-14(17)12(13(15)16)10-6-7-19-8-10/h2-8,12H,1H3,(H,15,16)