2-[6-[(4-butoxyphenyl)methoxy]-2,3-dihydro-1-benzofuran-3-yl]ethanoic acid

Systemtic Name: 2-[6-[(4-butoxyphenyl)methoxy]-2,3-dihydro-1-benzofuran-3-yl]ethanoic acid Openeye Name: 2-[6-[(4-butoxyphenyl)methoxy]-2,3-dihydrobenzofuran-3-yl]acetic acid CAS Name: 2-[6-[(4-butoxyphenyl)methoxy]-2,3-dihydrobenzofuran-3-yl]acetic acid IUPAC Name: 2-[6-[(4-butoxyphenyl)methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid Traditional Name: 2-[6-(4-butoxybenzyl)oxycoumaran-3-yl]acetic acid Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(CO3)CC(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(CO3)CC(=O)O

InChI

InChI=1S/C21H24O5/c1-2-3-10-24-17-6-4-15(5-7-17)13-25-18-8-9-19-16(11-21(22)23)14-26-20(19)12-18/h4-9,12,16H,2-3,10-11,13-14H2,1H3,(H,22,23)