(2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid; zinc

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid; zinc Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoic acid; zinc CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid; zinc IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid; zinc Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid; zinc Formula: C28H38N2O10Zn MolecularWeight: 628.01772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O.CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O.[Zn]

Isomeric SMILES

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

InChI

InChI=1S/2C14H19NO5.Zn/c2*1-14(2,3)20-13(19)15-11(12(17)18)8-9-4-6-10(16)7-5-9;/h2*4-7,11,16H,8H2,1-3H3,(H,15,19)(H,17,18);/t2*11-;/m00./s1