3-[3-(2,4-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl]oxy-2,2-dimethyl-propanoate

Systemtic Name: 3-[3-(2,4-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl]oxy-2,2-dimethyl-propanoate Openeye Name: 3-[3-(2,4-dimethylphenoxy)-4-oxo-chromen-7-yl]oxy-2,2-dimethyl-propanoate CAS Name: 3-[[3-(2,4-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]-2,2-dimethylpropanoate IUPAC Name: 3-[3-(2,4-dimethylphenoxy)-4-oxochromen-7-yl]oxy-2,2-dimethylpropanoate Traditional Name: 3-[3-(2,4-dimethylphenoxy)-4-keto-chromen-7-yl]oxy-2,2-dimethyl-propionate Formula: C22H21O6- MolecularWeight: 381.39854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(C)(C)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(C)(C)C(=O)[O-])C

InChI

InChI=1S/C22H22O6/c1-13-5-8-17(14(2)9-13)28-19-11-26-18-10-15(6-7-16(18)20(19)23)27-12-22(3,4)21(24)25/h5-11H,12H2,1-4H3,(H,24,25)/p-1