6,7-dimethyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6,7-dimethyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6,7-dimethyl-5-(2-methylenebutanoyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dimethyl-5-(2-methylene-1-oxobutyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6,7-dimethyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-(2-ethylacryloyl)-6,7-dimethyl-coumaran-2-carboxylic acid Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(=O)C1=CC2=C(C(=C1C)C)OC(C2)C(=O)O

Isomeric SMILES

CCC(=C)C(=O)C1=CC2=C(C(=C1C)C)OC(C2)C(=O)O

InChI

InChI=1S/C16H18O4/c1-5-8(2)14(17)12-6-11-7-13(16(18)19)20-15(11)10(4)9(12)3/h6,13H,2,5,7H2,1,3-4H3,(H,18,19)