1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-2-(cyclopropylmethylsulfanyl)ethanone

Systemtic Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-2-(cyclopropylmethylsulfanyl)ethanone Openeye Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-2-(cyclopropylmethylsulfanyl)ethanone CAS Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-2-(cyclopropylmethylthio)ethanone IUPAC Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-2-(cyclopropylmethylsulfanyl)ethanone Traditional Name: 1-(7-tert-butyl-3,3-dimethyl-coumaran-5-yl)-2-(cyclopropylmethylthio)ethanone Formula: C20H28O2S MolecularWeight: 332.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)CSCC3CC3)C

Isomeric SMILES

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)CSCC3CC3)C

InChI

InChI=1S/C20H28O2S/c1-19(2,3)15-8-14(17(21)11-23-10-13-6-7-13)9-16-18(15)22-12-20(16,4)5/h8-9,13H,6-7,10-12H2,1-5H3