butyl 2-(1-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate

Systemtic Name: butyl 2-(1-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate Openeye Name: butyl 2-(2-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-6-carboxylate CAS Name: 2-(1-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-6-carboxylic acid butyl ester IUPAC Name: butyl 2-(1-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate Traditional Name: 2-(2-hydroxy-1-methyl-ethyl)coumaran-6-carboxylic acid butyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(CC(O2)C(C)CO)C=C1

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(CC(O2)C(C)CO)C=C1

InChI

InChI=1S/C16H22O4/c1-3-4-7-19-16(18)13-6-5-12-8-14(11(2)10-17)20-15(12)9-13/h5-6,9,11,14,17H,3-4,7-8,10H2,1-2H3