2-(1-oxidanylbutylidene)-5-(4,5,6-trimethyl-2,3-dihydro-1-benzofuran-7-yl)cyclohexane-1,3-dione

Systemtic Name: 2-(1-oxidanylbutylidene)-5-(4,5,6-trimethyl-2,3-dihydro-1-benzofuran-7-yl)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-(4,5,6-trimethyl-2,3-dihydrobenzofuran-7-yl)cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5-(4,5,6-trimethyl-2,3-dihydrobenzofuran-7-yl)cyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5-(4,5,6-trimethyl-2,3-dihydro-1-benzofuran-7-yl)cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-(4,5,6-trimethylcoumaran-7-yl)cyclohexane-1,3-quinone Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=C3C(=C(C(=C2C)C)C)CCO3)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=C3C(=C(C(=C2C)C)C)CCO3)O

InChI

InChI=1S/C21H26O4/c1-5-6-16(22)20-17(23)9-14(10-18(20)24)19-13(4)11(2)12(3)15-7-8-25-21(15)19/h14,22H,5-10H2,1-4H3