2-ethoxy-3-(7-oxidanyl-1-benzothiophen-4-yl)propanoic acid

Systemtic Name: 2-ethoxy-3-(7-oxidanyl-1-benzothiophen-4-yl)propanoic acid Openeye Name: 2-ethoxy-3-(7-hydroxybenzothiophen-4-yl)propanoic acid CAS Name: 2-ethoxy-3-(7-hydroxy-1-benzothiophen-4-yl)propanoic acid IUPAC Name: 2-ethoxy-3-(7-hydroxy-1-benzothiophen-4-yl)propanoic acid Traditional Name: 2-ethoxy-3-(7-hydroxybenzothiophen-4-yl)propionic acid Formula: C13H14O4S MolecularWeight: 266.31286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=C2C=CSC2=C(C=C1)O)C(=O)O

Isomeric SMILES

CCOC(CC1=C2C=CSC2=C(C=C1)O)C(=O)O

InChI

InChI=1S/C13H14O4S/c1-2-17-11(13(15)16)7-8-3-4-10(14)12-9(8)5-6-18-12/h3-6,11,14H,2,7H2,1H3,(H,15,16)