ethyl (2S)-2-formamido-3-[2-iodanyl-5-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]propanoate

Systemtic Name: ethyl (2S)-2-formamido-3-[2-iodanyl-5-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]propanoate Openeye Name: ethyl (2S)-3-(4-tert-butoxycarbonyloxy-2-iodanyl-5-methoxy-phenyl)-2-formamido-propanoate CAS Name: (2S)-2-formamido-3-[2-iodanyl-5-methoxy-4-[(2-methylpropan-2-yl)oxy-oxomethoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-formamido-3-[2-iodanyl-5-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]propanoate Traditional Name: (2S)-3-(4-tert-butoxycarbonyloxy-2-iodanyl-5-methoxy-phenyl)-2-formamido-propionic acid ethyl ester Formula: C18H24INO7 MolecularWeight: 489.291258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1I)OC(=O)OC(C)(C)C)OC)NC=O

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC(=C(C=C1[123I])OC(=O)OC(C)(C)C)OC)NC=O

InChI

InChI=1S/C18H24INO7/c1-6-25-16(22)13(20-10-21)7-11-8-14(24-5)15(9-12(11)19)26-17(23)27-18(2,3)4/h8-10,13H,6-7H2,1-5H3,(H,20,21)/t13-/m0/s1/i19-4