3-tert-butyl-3H-1-benzofuran-2-one; 1-tert-butyl-2,3-dimethyl-benzene

Systemtic Name: 3-tert-butyl-3H-1-benzofuran-2-one; 1-tert-butyl-2,3-dimethyl-benzene Openeye Name: 3-tert-butyl-3H-benzofuran-2-one; 1-tert-butyl-2,3-dimethyl-benzene CAS Name: 3-tert-butyl-3H-benzofuran-2-one; 1-tert-butyl-2,3-dimethylbenzene IUPAC Name: 3-tert-butyl-3H-1-benzofuran-2-one; 1-tert-butyl-2,3-dimethylbenzene Traditional Name: 3-tert-butylcoumaran-2-one; 1-tert-butyl-2,3-dimethyl-benzene Formula: C24H32O2 MolecularWeight: 352.50968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)C.CC(C)(C)C1C2=CC=CC=C2OC1=O

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)C.CC(C)(C)C1C2=CC=CC=C2OC1=O

InChI

InChI=1S/C12H14O2.C12H18/c1-12(2,3)10-8-6-4-5-7-9(8)14-11(10)13;1-9-7-6-8-11(10(9)2)12(3,4)5/h4-7,10H,1-3H3;6-8H,1-5H3