methyl 3-(2-azanyl-4-nitro-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-(2-azanyl-4-nitro-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 3-(2-amino-4-nitro-1H-imidazol-5-yl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: 3-(2-amino-4-nitro-1H-imidazol-5-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2-amino-4-nitro-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(2-amino-4-nitro-1H-imidazol-5-yl)-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C12H19N5O6 MolecularWeight: 329.30916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(N=C(N1)N)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=C(N=C(N1)N)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H19N5O6/c1-12(2,3)23-11(19)15-7(9(18)22-4)5-6-8(17(20)21)16-10(13)14-6/h7H,5H2,1-4H3,(H,15,19)(H3,13,14,16)