3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoic acid

Systemtic Name: 3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)ethylamino]-3-(1-methylimidazol-4-yl)propanoic acid CAS Name: 3-(1-methyl-4-imidazolyl)-2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]propanoic acid IUPAC Name: 3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)ethylamino]-3-(1-methylimidazol-4-yl)propionic acid Formula: C14H24N4O4 MolecularWeight: 312.36476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC(CC1=CN(C=N1)C)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC(CC1=CN(C=N1)C)C(=O)O

InChI

InChI=1S/C14H24N4O4/c1-14(2,3)22-13(21)16-6-5-15-11(12(19)20)7-10-8-18(4)9-17-10/h8-9,11,15H,5-7H2,1-4H3,(H,16,21)(H,19,20)