ethyl 6-(4-butoxyphenyl)-3-methyl-4-oxidanyl-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 6-(4-butoxyphenyl)-3-methyl-4-oxidanyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 6-(4-butoxyphenyl)-4-hydroxy-3-methyl-benzofuran-2-carboxylate CAS Name: 6-(4-butoxyphenyl)-4-hydroxy-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-butoxyphenyl)-4-hydroxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 6-(4-butoxyphenyl)-4-hydroxy-3-methyl-coumarilic acid ethyl ester Formula: C22H24O5 MolecularWeight: 368.42296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC3=C(C(=C(O3)C(=O)OCC)C)C(=C2)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC3=C(C(=C(O3)C(=O)OCC)C)C(=C2)O

InChI

InChI=1S/C22H24O5/c1-4-6-11-26-17-9-7-15(8-10-17)16-12-18(23)20-14(3)21(22(24)25-5-2)27-19(20)13-16/h7-10,12-13,23H,4-6,11H2,1-3H3