propyl 2-[3-(2-chloranylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate

Systemtic Name: propyl 2-[3-(2-chloranylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate Openeye Name: propyl 2-[3-(2-chlorophenoxy)-4-oxo-chromen-7-yl]oxybutanoate CAS Name: 2-[[3-(2-chlorophenoxy)-4-oxo-1-benzopyran-7-yl]oxy]butanoic acid propyl ester IUPAC Name: propyl 2-[3-(2-chlorophenoxy)-4-oxochromen-7-yl]oxybutanoate Traditional Name: 2-[3-(2-chlorophenoxy)-4-keto-chromen-7-yl]oxybutyric acid propyl ester Formula: C22H21ClO6 MolecularWeight: 416.85154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CC)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Cl

Isomeric SMILES

CCCOC(=O)C(CC)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C22H21ClO6/c1-3-11-26-22(25)17(4-2)28-14-9-10-15-19(12-14)27-13-20(21(15)24)29-18-8-6-5-7-16(18)23/h5-10,12-13,17H,3-4,11H2,1-2H3