6-[(3-nitrophenyl)carbonylamino]hexanoate

Systemtic Name: 6-[(3-nitrophenyl)carbonylamino]hexanoate Openeye Name: 6-[(3-nitrobenzoyl)amino]hexanoate CAS Name: 6-[[(3-nitrophenyl)-oxomethyl]amino]hexanoate IUPAC Name: 6-[(3-nitrobenzoyl)amino]hexanoate Traditional Name: 6-[(3-nitrobenzoyl)amino]hexanoate Formula: C13H15N2O5- MolecularWeight: 279.2686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c16-12(17)7-2-1-3-8-14-13(18)10-5-4-6-11(9-10)15(19)20/h4-6,9H,1-3,7-8H2,(H,14,18)(H,16,17)/p-1