1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-5-methyl-hexan-1-one

Systemtic Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-5-methyl-hexan-1-one Openeye Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-5-methyl-hexan-1-one CAS Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-5-methyl-1-hexanone IUPAC Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-5-methylhexan-1-one Traditional Name: 1-(7-tert-butyl-3,3-dimethyl-coumaran-5-yl)-5-methyl-hexan-1-one Formula: C21H32O2 MolecularWeight: 316.47758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O2/c1-14(2)9-8-10-18(22)15-11-16(20(3,4)5)19-17(12-15)21(6,7)13-23-19/h11-12,14H,8-10,13H2,1-7H3