5-[[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylate

Systemtic Name: 5-[[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylate Openeye Name: 5-[[3-(4-chloro-3,5-dimethyl-phenoxy)-4-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylate IUPAC Name: 5-[[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[3-(4-chloro-3,5-dimethyl-phenoxy)-4-keto-chromen-7-yl]oxymethyl]-2-furoate Formula: C23H16ClO7- MolecularWeight: 439.82194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)[O-]

InChI

InChI=1S/C23H17ClO7/c1-12-7-16(8-13(2)21(12)24)31-20-11-29-19-9-14(3-5-17(19)22(20)25)28-10-15-4-6-18(30-15)23(26)27/h3-9,11H,10H2,1-2H3,(H,26,27)/p-1