4-[3-(2-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoic acid

Systemtic Name: 4-[3-(2-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoic acid Openeye Name: 4-[3-(2-methylphenoxy)-4-oxo-chromen-7-yl]oxybutanoic acid CAS Name: 4-[[3-(2-methylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]butanoic acid IUPAC Name: 4-[3-(2-methylphenoxy)-4-oxochromen-7-yl]oxybutanoic acid Traditional Name: 4-[4-keto-3-(2-methylphenoxy)chromen-7-yl]oxybutyric acid Formula: C20H18O6 MolecularWeight: 354.35332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCCCC(=O)O

InChI

InChI=1S/C20H18O6/c1-13-5-2-3-6-16(13)26-18-12-25-17-11-14(8-9-15(17)20(18)23)24-10-4-7-19(21)22/h2-3,5-6,8-9,11-12H,4,7,10H2,1H3,(H,21,22)