5-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[2-(4-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl]oxymethyl]-2-furoic acid Formula: C23H17ClO6 MolecularWeight: 424.83048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC4=CC=C(O4)C(=O)O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC4=CC=C(O4)C(=O)O)C

InChI

InChI=1S/C23H17ClO6/c1-12-9-17-19(10-13(12)2)30-21(14-3-5-15(24)6-4-14)22(20(17)25)28-11-16-7-8-18(29-16)23(26)27/h3-10H,11H2,1-2H3,(H,26,27)