7-[2,4-bis(oxidanylidene)pentan-3-ylidene]-6-chloranyl-3-(4-methylphenyl)carbonyl-4-oxidanylidene-1-benzofuran-5-olate

Systemtic Name: 7-[2,4-bis(oxidanylidene)pentan-3-ylidene]-6-chloranyl-3-(4-methylphenyl)carbonyl-4-oxidanylidene-1-benzofuran-5-olate Openeye Name: 7-(1-acetyl-2-oxo-propylidene)-6-chloro-3-(4-methylbenzoyl)-4-oxo-benzofuran-5-olate CAS Name: 6-chloro-7-(2,4-dioxopentan-3-ylidene)-3-[(4-methylphenyl)-oxomethyl]-4-oxo-5-benzofuranolate IUPAC Name: 6-chloro-7-(2,4-dioxopentan-3-ylidene)-3-(4-methylbenzoyl)-4-oxo-1-benzofuran-5-olate Traditional Name: 7-(1-acetyl-2-keto-propylidene)-6-chloro-4-keto-3-p-toluoyl-benzofuran-5-olate Formula: C21H14ClO6- MolecularWeight: 397.78526

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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/p-1