ethyl 2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate

Systemtic Name: ethyl 2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate Openeye Name: ethyl 2-[3-(3-methylphenoxy)-4-oxo-chromen-7-yl]oxybutanoate CAS Name: 2-[[3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(3-methylphenoxy)-4-oxochromen-7-yl]oxybutanoate Traditional Name: 2-[4-keto-3-(3-methylphenoxy)chromen-7-yl]oxybutyric acid ethyl ester Formula: C22H22O6 MolecularWeight: 382.40648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC(=C3)C

InChI

InChI=1S/C22H22O6/c1-4-18(22(24)25-5-2)27-16-9-10-17-19(12-16)26-13-20(21(17)23)28-15-8-6-7-14(3)11-15/h6-13,18H,4-5H2,1-3H3