3-methyl-2-propan-2-yl-butanoic acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene

Systemtic Name: 3-methyl-2-propan-2-yl-butanoic acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene Openeye Name: 2-isopropyl-3-methyl-butanoic acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene CAS Name: 3-methyl-2-propan-2-ylbutanoic acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene IUPAC Name: 3-methyl-2-propan-2-ylbutanoic acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene Traditional Name: 2-isopropyl-3-methyl-butyric acid; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)C(=O)O.C1=CC=C2C(=C1)O2

Isomeric SMILES

CC(C)C(C(C)C)C(=O)O.C1=CC=C2C(=C1)O2

InChI

InChI=1S/C8H16O2.C6H4O/c1-5(2)7(6(3)4)8(9)10;1-2-4-6-5(3-1)7-6/h5-7H,1-4H3,(H,9,10);1-4H