3-cyano-2-(5-methylthiophen-2-yl)propanoic acid

Systemtic Name: 3-cyano-2-(5-methylthiophen-2-yl)propanoic acid Openeye Name: 3-cyano-2-(5-methyl-2-thienyl)propanoic acid CAS Name: 3-cyano-2-(5-methyl-2-thiophenyl)propanoic acid IUPAC Name: 3-cyano-2-(5-methylthiophen-2-yl)propanoic acid Traditional Name: 3-cyano-2-(5-methyl-2-thienyl)propionic acid Formula: C9H9NO2S MolecularWeight: 195.23826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(CC#N)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(CC#N)C(=O)O

InChI

InChI=1S/C9H9NO2S/c1-6-2-3-8(13-6)7(4-5-10)9(11)12/h2-3,7H,4H2,1H3,(H,11,12)