methyl 4-[[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[3-(4-chloro-3,5-dimethyl-phenoxy)-4-oxo-chromen-7-yl]oxymethyl]benzoate CAS Name: 4-[[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxymethyl]benzoate Traditional Name: 4-[[3-(4-chloro-3,5-dimethyl-phenoxy)-4-keto-chromen-7-yl]oxymethyl]benzoic acid methyl ester Formula: C26H21ClO6 MolecularWeight: 464.89434

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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(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H21ClO6/c1-15-10-20(11-16(2)24(15)27)33-23-14-32-22-12-19(8-9-21(22)25(23)28)31-13-17-4-6-18(7-5-17)26(29)30-3/h4-12,14H,13H2,1-3H3