2-[(2-methyl-6-nitro-phenyl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(2-methyl-6-nitro-phenyl)carbonylamino]hexanoic acid Openeye Name: 2-[(2-methyl-6-nitro-benzoyl)amino]hexanoic acid CAS Name: 2-[[(2-methyl-6-nitrophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(2-methyl-6-nitrobenzoyl)amino]hexanoic acid Traditional Name: 2-[(2-methyl-6-nitro-benzoyl)amino]hexanoic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-3-4-7-10(14(18)19)15-13(17)12-9(2)6-5-8-11(12)16(20)21/h5-6,8,10H,3-4,7H2,1-2H3,(H,15,17)(H,18,19)