2-[(5-ethylthiophen-2-yl)methyl]propanedioic acid

Systemtic Name: 2-[(5-ethylthiophen-2-yl)methyl]propanedioic acid Openeye Name: 2-[(5-ethyl-2-thienyl)methyl]propanedioic acid CAS Name: 2-[(5-ethyl-2-thiophenyl)methyl]propanedioic acid IUPAC Name: 2-[(5-ethylthiophen-2-yl)methyl]propanedioic acid Traditional Name: 2-[(5-ethyl-2-thienyl)methyl]malonic acid Formula: C10H12O4S MolecularWeight: 228.26488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CC(C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C10H12O4S/c1-2-6-3-4-7(15-6)5-8(9(11)12)10(13)14/h3-4,8H,2,5H2,1H3,(H,11,12)(H,13,14)