[3-(iodanylmethoxycarbonyloxy)-2,2-dimethyl-propyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [3-(iodanylmethoxycarbonyloxy)-2,2-dimethyl-propyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: [3-(iodomethoxycarbonyloxy)-2,2-dimethyl-propyl] 2-(benzyloxycarbonylamino)-3-methyl-pentanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid [3-[iodomethoxy(oxo)methoxy]-2,2-dimethylpropyl] ester IUPAC Name: [3-(iodomethoxycarbonyloxy)-2,2-dimethylpropyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-valeric acid [3-(iodomethoxycarbonyloxy)-2,2-dimethyl-propyl] ester Formula: C21H30INO7 MolecularWeight: 535.36987

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30INO7/c1-5-15(2)17(23-19(25)27-11-16-9-7-6-8-10-16)18(24)28-12-21(3,4)13-29-20(26)30-14-22/h6-10,15,17H,5,11-14H2,1-4H3,(H,23,25)