3-(2-methylpropyl)-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one

Systemtic Name: 3-(2-methylpropyl)-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one Openeye Name: 3-isobutyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one CAS Name: 3-(2-methylpropyl)-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one IUPAC Name: 3-(2-methylpropyl)-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one Traditional Name: 3-isobutyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C2CCCC=C2C(=O)O1

Isomeric SMILES

CC(C)CC1C2CCCC=C2C(=O)O1

InChI

InChI=1S/C12H18O2/c1-8(2)7-11-9-5-3-4-6-10(9)12(13)14-11/h6,8-9,11H,3-5,7H2,1-2H3