methyl (2S,3S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-iodanyl-3-methyl-butanoate

Systemtic Name: methyl (2S,3S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-iodanyl-3-methyl-butanoate Openeye Name: methyl (2S,3S)-2-(1,3-dioxoisoindolin-2-yl)-4-iodo-3-methyl-butanoate CAS Name: (2S,3S)-2-(1,3-dioxo-2-isoindolyl)-4-iodo-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-(1,3-dioxoisoindol-2-yl)-4-iodo-3-methylbutanoate Traditional Name: (2S,3S)-4-iodo-3-methyl-2-phthalimido-butyric acid methyl ester Formula: C14H14INO4 MolecularWeight: 387.16973

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Descriptors Computed from Structure

Canonical SMILES:

CC(CI)C(C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

C[C@H](CI)[C@@H](C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C14H14INO4/c1-8(7-15)11(14(19)20-2)16-12(17)9-5-3-4-6-10(9)13(16)18/h3-6,8,11H,7H2,1-2H3/t8-,11+/m1/s1