iodanylzinc(1+); methyl (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]propanoate

Systemtic Name: iodanylzinc(1+); methyl (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]propanoate Openeye Name: iodozinc(1+); methyl (2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]propanoate CAS Name: iodozinc(1+); (2S)-2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]propanoic acid methyl ester IUPAC Name: iodozinc(1+); methyl (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]propionic acid methyl ester; iodozinc(1+) Formula: C18H25IN2O5Zn MolecularWeight: 541.71497

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC([CH2-])C(=O)OC.[Zn+]I

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([CH2-])C(=O)OC.[Zn+]I

InChI

InChI=1S/C18H25N2O5.HI.Zn/c1-12(16(22)24-5)19-15(21)14(11-13-9-7-6-8-10-13)20-17(23)25-18(2,3)4;;/h6-10,12,14H,1,11H2,2-5H3,(H,19,21)(H,20,23);1H;/q-1;;+2/p-1/t12-,14-;;/m0../s1