methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-iodanyl-4-phenylmethoxy-phenyl)propanoate

Systemtic Name: methyl (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-iodanyl-4-phenylmethoxy-phenyl)propanoate Openeye Name: methyl (2R)-3-(4-benzyloxy-3-iodo-phenyl)-2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)-3-(3-iodo-4-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(1,3-dioxoisoindol-2-yl)-3-(3-iodo-4-phenylmethoxyphenyl)propanoate Traditional Name: (2R)-3-(4-benzoxy-3-iodo-phenyl)-2-phthalimido-propionic acid methyl ester Formula: C25H20INO5 MolecularWeight: 541.33447

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)I)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)[C@@H](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)I)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H20INO5/c1-31-25(30)21(27-23(28)18-9-5-6-10-19(18)24(27)29)14-17-11-12-22(20(26)13-17)32-15-16-7-3-2-4-8-16/h2-13,21H,14-15H2,1H3/t21-/m1/s1