8-[[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]-4H-1,3-benzodioxine-6-carboxylic acid

Systemtic Name: 8-[[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]-4H-1,3-benzodioxine-6-carboxylic acid Openeye Name: 8-[[6-chloro-4-oxo-2-(p-tolyl)chromen-3-yl]oxymethyl]-4H-1,3-benzodioxine-6-carboxylic acid CAS Name: 8-[[6-chloro-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]-4H-1,3-benzodioxin-6-carboxylic acid IUPAC Name: 8-[[6-chloro-2-(4-methylphenyl)-4-oxochromen-3-yl]oxymethyl]-4H-1,3-benzodioxine-6-carboxylic acid Traditional Name: 8-[[6-chloro-4-keto-2-(p-tolyl)chromen-3-yl]oxymethyl]-4H-1,3-benzodioxin-6-carboxylic acid Formula: C26H19ClO7 MolecularWeight: 478.87786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC(=CC5=C4OCOC5)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC(=CC5=C4OCOC5)C(=O)O

InChI

InChI=1S/C26H19ClO7/c1-14-2-4-15(5-3-14)24-25(22(28)20-10-19(27)6-7-21(20)34-24)32-12-18-9-16(26(29)30)8-17-11-31-13-33-23(17)18/h2-10H,11-13H2,1H3,(H,29,30)