4-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-methyl-2,3-dihydrobenzofuran-5-yl)-4-oxo-butanoic acid CAS Name: 4-(2-methyl-2,3-dihydrobenzofuran-5-yl)-4-oxobutanoic acid IUPAC Name: 4-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-4-oxobutanoic acid Traditional Name: 4-keto-4-(2-methylcoumaran-5-yl)butyric acid Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C(=O)CCC(=O)O

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C13H14O4/c1-8-6-10-7-9(2-4-12(10)17-8)11(14)3-5-13(15)16/h2,4,7-8H,3,5-6H2,1H3,(H,15,16)