(phenylmethyl) 6-methyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: (phenylmethyl) 6-methyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: benzyl 6-methyl-5-(2-methylenebutanoyl)-2,3-dihydrobenzofuran-2-carboxylate CAS Name: 6-methyl-5-(2-methylene-1-oxobutyl)-2,3-dihydrobenzofuran-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-methyl-5-(2-methylidenebutanoyl)-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: 5-(2-ethylacryloyl)-6-methyl-coumaran-2-carboxylic acid benzyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(=O)C1=CC2=C(C=C1C)OC(C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(=C)C(=O)C1=CC2=C(C=C1C)OC(C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H22O4/c1-4-14(2)21(23)18-11-17-12-20(26-19(17)10-15(18)3)22(24)25-13-16-8-6-5-7-9-16/h5-11,20H,2,4,12-13H2,1,3H3