3-[6-chloranyl-3-(4-methylphenyl)carbonyl-5-oxidanyl-4-oxidanylidene-1-benzofuran-7-ylidene]pentane-2,4-dione

Systemtic Name: 3-[6-chloranyl-3-(4-methylphenyl)carbonyl-5-oxidanyl-4-oxidanylidene-1-benzofuran-7-ylidene]pentane-2,4-dione Openeye Name: 3-[6-chloro-5-hydroxy-3-(4-methylbenzoyl)-4-oxo-benzofuran-7-ylidene]pentane-2,4-dione CAS Name: 3-[6-chloro-5-hydroxy-3-[(4-methylphenyl)-oxomethyl]-4-oxo-7-benzofuranylidene]pentane-2,4-dione IUPAC Name: 3-[6-chloro-5-hydroxy-3-(4-methylbenzoyl)-4-oxo-1-benzofuran-7-ylidene]pentane-2,4-dione Traditional Name: 3-(6-chloro-5-hydroxy-4-keto-3-p-toluoyl-benzofuran-7-ylidene)pentane-2,4-dione Formula: C21H15ClO6 MolecularWeight: 398.7932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=COC3=C2C(=O)C(=C(C3=C(C(=O)C)C(=O)C)Cl)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=COC3=C2C(=O)C(=C(C3=C(C(=O)C)C(=O)C)Cl)O

InChI

InChI=1S/C21H15ClO6/c1-9-4-6-12(7-5-9)18(25)13-8-28-21-15(13)19(26)20(27)17(22)16(21)14(10(2)23)11(3)24/h4-8,27H,1-3H3