1-methyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]imidazole-2-carboxylic acid

Systemtic Name: 1-methyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]imidazole-2-carboxylic acid Openeye Name: 4-[3-(tert-butoxycarbonylamino)propanoylamino]-1-methyl-imidazole-2-carboxylic acid CAS Name: 1-methyl-4-[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-2-imidazolecarboxylic acid IUPAC Name: 1-methyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]imidazole-2-carboxylic acid Traditional Name: 4-[3-(tert-butoxycarbonylamino)propanoylamino]-1-methyl-imidazole-2-carboxylic acid Formula: C13H20N4O5 MolecularWeight: 312.3217

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NC1=CN(C(=N1)C(=O)O)C

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NC1=CN(C(=N1)C(=O)O)C

InChI

InChI=1S/C13H20N4O5/c1-13(2,3)22-12(21)14-6-5-9(18)15-8-7-17(4)10(16-8)11(19)20/h7H,5-6H2,1-4H3,(H,14,21)(H,15,18)(H,19,20)