5-[[6-chloranyl-2-(4-chlorophenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[6-chloranyl-2-(4-chlorophenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[6-chloro-2-(4-chlorophenyl)-4-oxo-chromen-3-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[6-chloro-2-(4-chlorophenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[6-chloro-2-(4-chlorophenyl)-4-oxochromen-3-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[6-chloro-2-(4-chlorophenyl)-4-keto-chromen-3-yl]oxymethyl]-2-furoic acid Formula: C21H12Cl2O6 MolecularWeight: 431.22238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=C(O4)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=C(O4)C(=O)O)Cl

InChI

InChI=1S/C21H12Cl2O6/c22-12-3-1-11(2-4-12)19-20(27-10-14-6-8-17(28-14)21(25)26)18(24)15-9-13(23)5-7-16(15)29-19/h1-9H,10H2,(H,25,26)