3-(furan-3-yl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydro-2-benzofuran-1-one

Systemtic Name: 3-(furan-3-yl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydro-2-benzofuran-1-one Openeye Name: 3-(3-furyl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydroisobenzofuran-1-one CAS Name: 3-(3-furanyl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydroisobenzofuran-1-one IUPAC Name: 3-(furan-3-yl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydro-2-benzofuran-1-one Traditional Name: 3-(3-furyl)-3a,7-dimethyl-3,4,5,6,7,7a-hexahydroisobenzofuran-1-one Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2(C1C(=O)OC2C3=COC=C3)C

Isomeric SMILES

CC1CCCC2(C1C(=O)OC2C3=COC=C3)C

InChI

InChI=1S/C14H18O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-9,11-12H,3-4,6H2,1-2H3