[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-iodanyl-2,3-dimethoxy-6-[2,2,2-tris(chloranyl)ethanoylamino]cyclohexyl] ethanoate

Systemtic Name: [4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-iodanyl-2,3-dimethoxy-6-[2,2,2-tris(chloranyl)ethanoylamino]cyclohexyl] ethanoate Openeye Name: [4-(1,3-dioxoisoindolin-2-yl)-5-iodo-2,3-dimethoxy-6-[(2,2,2-trichloroacetyl)amino]cyclohexyl] acetate CAS Name: acetic acid [4-(1,3-dioxo-2-isoindolyl)-5-iodo-2,3-dimethoxy-6-[(2,2,2-trichloro-1-oxoethyl)amino]cyclohexyl] ester IUPAC Name: [4-(1,3-dioxoisoindol-2-yl)-5-iodo-2,3-dimethoxy-6-[(2,2,2-trichloroacetyl)amino]cyclohexyl] acetate Traditional Name: acetic acid [5-iodo-2,3-dimethoxy-4-phthalimido-6-[(2,2,2-trichloroacetyl)amino]cyclohexyl] ester Formula: C20H20Cl3IN2O7 MolecularWeight: 633.64547

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(C(C1OC)OC)N2C(=O)C3=CC=CC=C3C2=O)I)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CC(=O)OC1C(C(C(C(C1OC)OC)N2C(=O)C3=CC=CC=C3C2=O)I)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C20H20Cl3IN2O7/c1-8(27)33-14-12(25-19(30)20(21,22)23)11(24)13(15(31-2)16(14)32-3)26-17(28)9-6-4-5-7-10(9)18(26)29/h4-7,11-16H,1-3H3,(H,25,30)