2-[4-(3-methylthiophen-2-yl)phenyl]propanedioic acid

Systemtic Name: 2-[4-(3-methylthiophen-2-yl)phenyl]propanedioic acid Openeye Name: 2-[4-(3-methyl-2-thienyl)phenyl]propanedioic acid CAS Name: 2-[4-(3-methyl-2-thiophenyl)phenyl]propanedioic acid IUPAC Name: 2-[4-(3-methylthiophen-2-yl)phenyl]propanedioic acid Traditional Name: 2-[4-(3-methyl-2-thienyl)phenyl]malonic acid Formula: C14H12O4S MolecularWeight: 276.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=CC=C(C=C2)C(C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C2=CC=C(C=C2)C(C(=O)O)C(=O)O

InChI

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