1-(2,3-dihydro-1-benzofuran-5-yl)-2-ethyl-hexan-1-one

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-yl)-2-ethyl-hexan-1-one Openeye Name: 1-(2,3-dihydrobenzofuran-5-yl)-2-ethyl-hexan-1-one CAS Name: 1-(2,3-dihydrobenzofuran-5-yl)-2-ethyl-1-hexanone IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-yl)-2-ethylhexan-1-one Traditional Name: 1-coumaran-5-yl-2-ethyl-hexan-1-one Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)C1=CC2=C(C=C1)OCC2

Isomeric SMILES

CCCCC(CC)C(=O)C1=CC2=C(C=C1)OCC2

InChI

InChI=1S/C16H22O2/c1-3-5-6-12(4-2)16(17)14-7-8-15-13(11-14)9-10-18-15/h7-8,11-12H,3-6,9-10H2,1-2H3