5-[[3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[3-(4-chlorophenyl)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(4-chlorophenyl)-4-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-(4-chlorophenyl)-4-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(4-chlorophenyl)-4-oxochromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[3-(4-chlorophenyl)-4-keto-chromen-7-yl]oxymethyl]-2-furoic acid Formula: C21H13ClO6 MolecularWeight: 396.77732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)Cl

InChI

InChI=1S/C21H13ClO6/c22-13-3-1-12(2-4-13)17-11-27-19-9-14(5-7-16(19)20(17)23)26-10-15-6-8-18(28-15)21(24)25/h1-9,11H,10H2,(H,24,25)