4-[(1-methylimidazol-2-yl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(1-methylimidazol-2-yl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate Openeye Name: 2-(tert-butoxycarbonylamino)-4-[(1-methylimidazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[(1-methyl-2-imidazolyl)amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxobutanoate IUPAC Name: 4-[(1-methylimidazol-2-yl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-keto-4-[(1-methylimidazol-2-yl)amino]butyrate Formula: C13H19N4O5- MolecularWeight: 311.31376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)NC1=NC=CN1C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)NC1=NC=CN1C)C(=O)[O-]

InChI

InChI=1S/C13H20N4O5/c1-13(2,3)22-12(21)15-8(10(19)20)7-9(18)16-11-14-5-6-17(11)4/h5-6,8H,7H2,1-4H3,(H,15,21)(H,19,20)(H,14,16,18)/p-1