2-methyl-5-nitro-N-pentan-2-yl-aniline

Systemtic Name: 2-methyl-5-nitro-N-pentan-2-yl-aniline Openeye Name: 2-methyl-N-(1-methylbutyl)-5-nitro-aniline CAS Name: 2-methyl-5-nitro-N-pentan-2-ylaniline IUPAC Name: 2-methyl-5-nitro-N-pentan-2-ylaniline Traditional Name: 1-methylbutyl-(2-methyl-5-nitro-phenyl)amine Formula: C12H18N2O2 MolecularWeight: 222.28352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O2/c1-4-5-10(3)13-12-8-11(14(15)16)7-6-9(12)2/h6-8,10,13H,4-5H2,1-3H3