[2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 2-iodanylbenzoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 2-iodanylbenzoate Openeye Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxo-chromen-3-yl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxochromen-3-yl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [2-(3,4-dimethoxyphenyl)-4-keto-5,7-dimethyl-chromen-3-yl] ester Formula: C26H21IO6 MolecularWeight: 556.34581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3I)C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3I)C4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C26H21IO6/c1-14-11-15(2)22-21(12-14)32-24(16-9-10-19(30-3)20(13-16)31-4)25(23(22)28)33-26(29)17-7-5-6-8-18(17)27/h5-13H,1-4H3