(E)-3-[7-(3-methylbut-2-enyl)-2-(1-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[7-(3-methylbut-2-enyl)-2-(1-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-(2-hydroxy-1-methyl-ethyl)-7-(3-methylbut-2-enyl)-2,3-dihydrobenzofuran-5-yl]prop-2-enoic acid CAS Name: (E)-3-[2-(1-hydroxypropan-2-yl)-7-(3-methylbut-2-enyl)-2,3-dihydrobenzofuran-5-yl]-2-propenoic acid IUPAC Name: (E)-3-[2-(1-hydroxypropan-2-yl)-7-(3-methylbut-2-enyl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-(2-hydroxy-1-methyl-ethyl)-7-(3-methylbut-2-enyl)coumaran-5-yl]acrylic acid Formula: C19H24O4 MolecularWeight: 316.39146

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C1CC2=C(O1)C(=CC(=C2)C=CC(=O)O)CC=C(C)C

Isomeric SMILES

CC(CO)C1CC2=C(O1)C(=CC(=C2)/C=C/C(=O)O)CC=C(C)C

InChI

InChI=1S/C19H24O4/c1-12(2)4-6-15-8-14(5-7-18(21)22)9-16-10-17(13(3)11-20)23-19(15)16/h4-5,7-9,13,17,20H,6,10-11H2,1-3H3,(H,21,22)/b7-5+