N-[(4-methyl-3-nitro-phenyl)methyl]pentan-3-amine

Systemtic Name: N-[(4-methyl-3-nitro-phenyl)methyl]pentan-3-amine Openeye Name: N-[(4-methyl-3-nitro-phenyl)methyl]pentan-3-amine CAS Name: N-[(4-methyl-3-nitrophenyl)methyl]-3-pentanamine IUPAC Name: N-[(4-methyl-3-nitrophenyl)methyl]pentan-3-amine Traditional Name: 1-ethylpropyl-(4-methyl-3-nitro-benzyl)amine Formula: C13H20N2O2 MolecularWeight: 236.3101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NCC1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O2/c1-4-12(5-2)14-9-11-7-6-10(3)13(8-11)15(16)17/h6-8,12,14H,4-5,9H2,1-3H3