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

Systemtic Name: 6-methyl-5-(2-methylidenepentanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6-methyl-5-(2-methylenepentanoyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6-methyl-5-(2-methylene-1-oxopentyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6-methyl-5-(2-methylidenepentanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6-methyl-5-(2-propylacryloyl)coumaran-2-carboxylic acid Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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