3-[(4-methoxyphenyl)methoxycarbonyl]-2-methyl-5-oxidanylidene-6H-1-benzofuran-4-carboxylic acid

Systemtic Name: 3-[(4-methoxyphenyl)methoxycarbonyl]-2-methyl-5-oxidanylidene-6H-1-benzofuran-4-carboxylic acid Openeye Name: 3-[(4-methoxyphenyl)methoxycarbonyl]-2-methyl-5-oxo-6H-benzofuran-4-carboxylic acid CAS Name: 3-[(4-methoxyphenyl)methoxy-oxomethyl]-2-methyl-5-oxo-6H-benzofuran-4-carboxylic acid IUPAC Name: 3-[(4-methoxyphenyl)methoxycarbonyl]-2-methyl-5-oxo-6H-1-benzofuran-4-carboxylic acid Traditional Name: 5-keto-2-methyl-3-p-anisyloxycarbonyl-6H-benzofuran-4-carboxylic acid Formula: C19H16O7 MolecularWeight: 356.32614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=O)CC=C2O1)C(=O)O)C(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C2=C(C(=O)CC=C2O1)C(=O)O)C(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H16O7/c1-10-15(17-14(26-10)8-7-13(20)16(17)18(21)22)19(23)25-9-11-3-5-12(24-2)6-4-11/h3-6,8H,7,9H2,1-2H3,(H,21,22)