2-azanyl-N-(2-methyl-3-nitro-phenyl)pentanamide

Systemtic Name: 2-azanyl-N-(2-methyl-3-nitro-phenyl)pentanamide Openeye Name: 2-amino-N-(2-methyl-3-nitro-phenyl)pentanamide CAS Name: 2-amino-N-(2-methyl-3-nitrophenyl)pentanamide IUPAC Name: 2-amino-N-(2-methyl-3-nitrophenyl)pentanamide Traditional Name: 2-amino-N-(2-methyl-3-nitro-phenyl)valeramide Formula: C12H17N3O3 MolecularWeight: 251.28168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=C(C(=CC=C1)[N+](=O)[O-])C)N

Isomeric SMILES

CCCC(C(=O)NC1=C(C(=CC=C1)[N+](=O)[O-])C)N

InChI

InChI=1S/C12H17N3O3/c1-3-5-9(13)12(16)14-10-6-4-7-11(8(10)2)15(17)18/h4,6-7,9H,3,5,13H2,1-2H3,(H,14,16)