3-[3-(3,5-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: 3-[3-(3,5-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: 3-[3-(3,5-dimethylphenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 3-[[3-(3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: 3-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 3-[3-(3,5-dimethylphenoxy)-4-keto-chromen-7-yl]oxypropionate Formula: C20H17O6- MolecularWeight: 353.34538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O6/c1-12-7-13(2)9-15(8-12)26-18-11-25-17-10-14(24-6-5-19(21)22)3-4-16(17)20(18)23/h3-4,7-11H,5-6H2,1-2H3,(H,21,22)/p-1