5-methyl-3-[[[2-(nitrooxymethyl)phenyl]carbonylamino]methyl]hexanoic acid

Systemtic Name: 5-methyl-3-[[[2-(nitrooxymethyl)phenyl]carbonylamino]methyl]hexanoic acid Openeye Name: 5-methyl-3-[[[2-(nitrooxymethyl)benzoyl]amino]methyl]hexanoic acid CAS Name: 5-methyl-3-[[[[2-(nitrooxymethyl)phenyl]-oxomethyl]amino]methyl]hexanoic acid IUPAC Name: 5-methyl-3-[[[2-(nitrooxymethyl)benzoyl]amino]methyl]hexanoic acid Traditional Name: 5-methyl-3-[[[2-(nitrooxymethyl)benzoyl]amino]methyl]hexanoic acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)CNC(=O)C1=CC=CC=C1CO[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(CC(=O)O)CNC(=O)C1=CC=CC=C1CO[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O6/c1-11(2)7-12(8-15(19)20)9-17-16(21)14-6-4-3-5-13(14)10-24-18(22)23/h3-6,11-12H,7-10H2,1-2H3,(H,17,21)(H,19,20)