5-methyl-3-[(4-nitrooxybutanoylamino)methyl]hexanoic acid

Systemtic Name: 5-methyl-3-[(4-nitrooxybutanoylamino)methyl]hexanoic acid Openeye Name: 5-methyl-3-[(4-nitrooxybutanoylamino)methyl]hexanoic acid CAS Name: 5-methyl-3-[[(4-nitrooxy-1-oxobutyl)amino]methyl]hexanoic acid IUPAC Name: 5-methyl-3-[(4-nitrooxybutanoylamino)methyl]hexanoic acid Traditional Name: 5-methyl-3-[(4-nitrooxybutanoylamino)methyl]hexanoic acid Formula: C12H22N2O6 MolecularWeight: 290.31288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)CNC(=O)CCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(CC(=O)O)CNC(=O)CCCO[N+](=O)[O-]

InChI

InChI=1S/C12H22N2O6/c1-9(2)6-10(7-12(16)17)8-13-11(15)4-3-5-20-14(18)19/h9-10H,3-8H2,1-2H3,(H,13,15)(H,16,17)