[3-(iodanylmethoxy)-2,2-dimethyl-3-oxidanylidene-propyl] (2S,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [3-(iodanylmethoxy)-2,2-dimethyl-3-oxidanylidene-propyl] (2S,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: [3-(iodomethoxy)-2,2-dimethyl-3-oxo-propyl] (2S,3S)-2-(benzyloxycarbonylamino)-3-methyl-pentanoate CAS Name: (2S,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid [3-(iodomethoxy)-2,2-dimethyl-3-oxopropyl] ester IUPAC Name: [3-(iodomethoxy)-2,2-dimethyl-3-oxopropyl] (2S,3S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S,3S)-2-(benzyloxycarbonylamino)-3-methyl-valeric acid [3-(iodomethoxy)-3-keto-2,2-dimethyl-propyl] ester Formula: C20H28INO6 MolecularWeight: 505.34389

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC(C)(C)C(=O)OCI)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OCC(C)(C)C(=O)OCI)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H28INO6/c1-5-14(2)16(17(23)27-12-20(3,4)18(24)28-13-21)22-19(25)26-11-15-9-7-6-8-10-15/h6-10,14,16H,5,11-13H2,1-4H3,(H,22,25)/t14-,16-/m0/s1