N-[(4-bromanyl-3-nitro-phenyl)methyl]-2-methyl-aniline

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-2-methyl-aniline Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-2-methyl-aniline CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-2-methylaniline IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-2-methylaniline Traditional Name: (4-bromo-3-nitro-benzyl)-(o-tolyl)amine Formula: C14H13BrN2O2 MolecularWeight: 321.16922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H13BrN2O2/c1-10-4-2-3-5-13(10)16-9-11-6-7-12(15)14(8-11)17(18)19/h2-8,16H,9H2,1H3