5-(7-chloranyl-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione

Systemtic Name: 5-(7-chloranyl-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione Openeye Name: 5-(7-chloro-2,2,4,5-tetramethyl-3H-benzofuran-6-yl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione CAS Name: 5-(7-chloro-2,2,4,5-tetramethyl-3H-benzofuran-6-yl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione IUPAC Name: 5-(7-chloro-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione Traditional Name: 5-(7-chloro-2,2,4,5-tetramethyl-coumaran-6-yl)-2-(1-hydroxypropylidene)cyclohexane-1,3-quinone Formula: C21H25ClO4 MolecularWeight: 376.8738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)CC(CC1=O)C2=C(C(=C3CC(OC3=C2Cl)(C)C)C)C)O

Isomeric SMILES

CCC(=C1C(=O)CC(CC1=O)C2=C(C(=C3CC(OC3=C2Cl)(C)C)C)C)O

InChI

InChI=1S/C21H25ClO4/c1-6-14(23)18-15(24)7-12(8-16(18)25)17-11(3)10(2)13-9-21(4,5)26-20(13)19(17)22/h12,23H,6-9H2,1-5H3