6-[[azanyl-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]-2-nitramido-hexanoic acid

Systemtic Name: 6-[[azanyl-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]-2-nitramido-hexanoic acid Openeye Name: 6-[[amino-(tert-butoxycarbonylamino)methylene]amino]-2-nitramido-hexanoic acid CAS Name: 6-[[amino-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylidene]amino]-2-nitramidohexanoic acid IUPAC Name: 6-[[amino-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]-2-nitramidohexanoic acid Traditional Name: 6-[[amino-(tert-butoxycarbonylamino)methylene]amino]-2-nitramido-hexanoic acid Formula: C12H23N5O6 MolecularWeight: 333.34092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23N5O6/c1-12(2,3)23-11(20)15-10(13)14-7-5-4-6-8(9(18)19)16-17(21)22/h8,16H,4-7H2,1-3H3,(H,18,19)(H3,13,14,15,20)