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

Systemtic Name: 2-methylpropyl 2-[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C24H25ClO6 MolecularWeight: 444.9047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(C)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(C)C(=O)OCC(C)C

InChI

InChI=1S/C24H25ClO6/c1-13(2)11-29-24(27)16(5)30-17-6-7-19-20(10-17)28-12-21(23(19)26)31-18-8-14(3)22(25)15(4)9-18/h6-10,12-13,16H,11H2,1-5H3