4-[[6,7-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[6,7-dimethyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxymethyl]benzoic acid Openeye Name: 4-[[6,7-dimethyl-4-oxo-2-(p-tolyl)chromen-3-yl]oxymethyl]benzoic acid CAS Name: 4-[[6,7-dimethyl-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl]oxymethyl]benzoic acid IUPAC Name: 4-[[6,7-dimethyl-2-(4-methylphenyl)-4-oxochromen-3-yl]oxymethyl]benzoic acid Traditional Name: 4-[[4-keto-6,7-dimethyl-2-(p-tolyl)chromen-3-yl]oxymethyl]benzoic acid Formula: C26H22O5 MolecularWeight: 414.44988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=C(C=C3O2)C)C)OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=C(C=C3O2)C)C)OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H22O5/c1-15-4-8-19(9-5-15)24-25(30-14-18-6-10-20(11-7-18)26(28)29)23(27)21-12-16(2)17(3)13-22(21)31-24/h4-13H,14H2,1-3H3,(H,28,29)