[2-(4-tert-butylphenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 2-iodanylbenzoate

Systemtic Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 2-iodanylbenzoate Openeye Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxo-chromen-3-yl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [2-(4-tert-butylphenyl)-6-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxochromen-3-yl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [2-(4-tert-butylphenyl)-4-keto-6-methyl-chromen-3-yl] ester Formula: C27H23IO4 MolecularWeight: 538.37359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3I)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3I)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H23IO4/c1-16-9-14-22-20(15-16)23(29)25(32-26(30)19-7-5-6-8-21(19)28)24(31-22)17-10-12-18(13-11-17)27(2,3)4/h5-15H,1-4H3