6-methyl-5-(3-methyl-2-methylidene-butanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6-methyl-5-(3-methyl-2-methylidene-butanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6-methyl-5-(3-methyl-2-methylene-butanoyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6-methyl-5-(3-methyl-2-methylene-1-oxobutyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6-methyl-5-(3-methyl-2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-(2-isopropylacryloyl)-6-methyl-coumaran-2-carboxylic acid Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(O2)C(=O)O)C=C1C(=O)C(=C)C(C)C

Isomeric SMILES

CC1=CC2=C(CC(O2)C(=O)O)C=C1C(=O)C(=C)C(C)C

InChI

InChI=1S/C16H18O4/c1-8(2)10(4)15(17)12-6-11-7-14(16(18)19)20-13(11)5-9(12)3/h5-6,8,14H,4,7H2,1-3H3,(H,18,19)