(4-oxidanylidene-4-phenyl-butyl) 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-oxo-4-phenyl-butyl) 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid (4-keto-4-phenyl-butyl) ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OCCCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OCCCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18O4/c1-14-16-10-5-6-12-18(16)24-19(14)20(22)23-13-7-11-17(21)15-8-3-2-4-9-15/h2-6,8-10,12H,7,11,13H2,1H3