2-[(3-nitrophenyl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(3-nitrophenyl)carbonylamino]hexanoic acid Openeye Name: 2-[(3-nitrobenzoyl)amino]hexanoic acid CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(3-nitrobenzoyl)amino]hexanoic acid Traditional Name: 2-[(3-nitrobenzoyl)amino]hexanoic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5/c1-2-3-7-11(13(17)18)14-12(16)9-5-4-6-10(8-9)15(19)20/h4-6,8,11H,2-3,7H2,1H3,(H,14,16)(H,17,18)