2-(1-ethyl-3-oxidanylidene-2-benzofuran-1-yl)ethanoic acid

Systemtic Name: 2-(1-ethyl-3-oxidanylidene-2-benzofuran-1-yl)ethanoic acid Openeye Name: 2-(1-ethyl-3-oxo-isobenzofuran-1-yl)acetic acid CAS Name: 2-(1-ethyl-3-oxo-1-isobenzofuranyl)acetic acid IUPAC Name: 2-(1-ethyl-3-oxo-2-benzofuran-1-yl)acetic acid Traditional Name: 2-(1-ethyl-3-keto-phthalan-1-yl)acetic acid Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2C(=O)O1)CC(=O)O

Isomeric SMILES

CCC1(C2=CC=CC=C2C(=O)O1)CC(=O)O

InChI

InChI=1S/C12H12O4/c1-2-12(7-10(13)14)9-6-4-3-5-8(9)11(15)16-12/h3-6H,2,7H2,1H3,(H,13,14)