1-(2,3-dimethyl-5-nitro-phenyl)pentan-1-amine

Systemtic Name: 1-(2,3-dimethyl-5-nitro-phenyl)pentan-1-amine Openeye Name: 1-(2,3-dimethyl-5-nitro-phenyl)pentan-1-amine CAS Name: 1-(2,3-dimethyl-5-nitrophenyl)-1-pentanamine IUPAC Name: 1-(2,3-dimethyl-5-nitrophenyl)pentan-1-amine Traditional Name: 1-(2,3-dimethyl-5-nitro-phenyl)pentylamine Formula: C13H20N2O2 MolecularWeight: 236.3101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2/c1-4-5-6-13(14)12-8-11(15(16)17)7-9(2)10(12)3/h7-8,13H,4-6,14H2,1-3H3