5-[bis(azanyl)methylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-pentanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-5-guanidino-2-nitro-pentanoic acid CAS Name: 5-(diaminomethylideneamino)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-nitropentanoic acid IUPAC Name: 5-(diaminomethylideneamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitropentanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-5-guanidino-2-nitro-valeric acid Formula: C11H21N5O6 MolecularWeight: 319.31434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H21N5O6/c1-10(2,3)22-9(19)15-11(7(17)18,16(20)21)5-4-6-14-8(12)13/h4-6H2,1-3H3,(H,15,19)(H,17,18)(H4,12,13,14)