1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropyl-but-2-yne-1,4-dione

Systemtic Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropyl-but-2-yne-1,4-dione Openeye Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-4-cyclopropyl-but-2-yne-1,4-dione CAS Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzofuran-5-yl)-4-cyclopropyl-2-butyne-1,4-dione IUPAC Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-4-cyclopropylbut-2-yne-1,4-dione Traditional Name: 1-(7-tert-butyl-3,3-dimethyl-coumaran-5-yl)-4-cyclopropyl-but-2-yne-1,4-dione Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)C#CC(=O)C3CC3)C

Isomeric SMILES

CC1(COC2=C1C=C(C=C2C(C)(C)C)C(=O)C#CC(=O)C3CC3)C

InChI

InChI=1S/C21H24O3/c1-20(2,3)15-10-14(11-16-19(15)24-12-21(16,4)5)18(23)9-8-17(22)13-6-7-13/h10-11,13H,6-7,12H2,1-5H3