ethyl 2-[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: ethyl 2-[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: ethyl 2-[3-(4-chloro-3,5-dimethyl-phenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[3-(4-chloro-3,5-dimethyl-phenoxy)-4-keto-chromen-7-yl]oxypropionic acid ethyl ester Formula: C22H21ClO6 MolecularWeight: 416.85154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C22H21ClO6/c1-5-26-22(25)14(4)28-15-6-7-17-18(10-15)27-11-19(21(17)24)29-16-8-12(2)20(23)13(3)9-16/h6-11,14H,5H2,1-4H3