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

Systemtic Name: 5-[[3-(3-methyl-4-propan-2-yl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(4-isopropyl-3-methyl-phenoxy)-4-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxochromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[3-(4-isopropyl-3-methyl-phenoxy)-4-keto-chromen-7-yl]oxymethyl]-2-furoic acid Formula: C25H22O7 MolecularWeight: 434.43798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C(C)C

InChI

InChI=1S/C25H22O7/c1-14(2)19-7-5-17(10-15(19)3)31-23-13-30-22-11-16(4-8-20(22)24(23)26)29-12-18-6-9-21(32-18)25(27)28/h4-11,13-14H,12H2,1-3H3,(H,27,28)