3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-oxo-propanoic acid CAS Name: 3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-oxopropanoic acid IUPAC Name: 3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-oxopropanoic acid Traditional Name: 3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-2-keto-propionic acid Formula: C14H16O5 MolecularWeight: 264.27384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CC(=O)C(=O)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CC(=O)C(=O)O

InChI

InChI=1S/C14H16O5/c1-3-18-12-6-9-4-8(2)19-13(9)7-10(12)5-11(15)14(16)17/h6-8H,3-5H2,1-2H3,(H,16,17)/t8-/m0/s1