4-nitro-2-[(4-nitro-1-oxidanyl-1-oxidanylidene-pentan-2-yl)diazenyl]pentanoic acid

Systemtic Name: 4-nitro-2-[(4-nitro-1-oxidanyl-1-oxidanylidene-pentan-2-yl)diazenyl]pentanoic acid Openeye Name: 2-(1-carboxy-3-nitro-butyl)azo-4-nitro-pentanoic acid CAS Name: 2-(1-hydroxy-4-nitro-1-oxopentan-2-yl)azo-4-nitropentanoic acid IUPAC Name: 2-[(1-hydroxy-4-nitro-1-oxopentan-2-yl)diazenyl]-4-nitropentanoic acid Traditional Name: 2-(1-carboxy-3-nitro-butyl)azo-4-nitro-valeric acid Formula: C10H16N4O8 MolecularWeight: 320.25604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N4O8/c1-5(13(19)20)3-7(9(15)16)11-12-8(10(17)18)4-6(2)14(21)22/h5-8H,3-4H2,1-2H3,(H,15,16)(H,17,18)