(E)-1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropyl-but-2-en-1-one

Systemtic Name: (E)-1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropyl-but-2-en-1-one Openeye Name: (E)-1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-4-cyclopropyl-but-2-en-1-one CAS Name: (E)-1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-4-cyclopropyl-2-buten-1-one IUPAC Name: (E)-1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropylbut-2-en-1-one Traditional Name: (E)-1-(7-tert-butyl-3,3-dimethyl-coumaran-5-yl)-4-cyclopropyl-but-2-en-1-one Formula: C21H28O2 MolecularWeight: 312.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)C=CCC3CC3)C

Isomeric SMILES

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)/C=C/CC3CC3)C

InChI

InChI=1S/C21H28O2/c1-20(2,3)16-11-15(18(22)8-6-7-14-9-10-14)12-17-19(16)23-13-21(17,4)5/h6,8,11-12,14H,7,9-10,13H2,1-5H3/b8-6+