3-[[(4-bromanyl-2-nitro-phenyl)amino]methyl]phenol

Systemtic Name: 3-[[(4-bromanyl-2-nitro-phenyl)amino]methyl]phenol Openeye Name: 3-[(4-bromo-2-nitro-anilino)methyl]phenol CAS Name: 3-[(4-bromo-2-nitroanilino)methyl]phenol IUPAC Name: 3-[(4-bromo-2-nitroanilino)methyl]phenol Traditional Name: 3-[(4-bromo-2-nitro-anilino)methyl]phenol Formula: C13H11BrN2O3 MolecularWeight: 323.14204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)O)CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H11BrN2O3/c14-10-4-5-12(13(7-10)16(18)19)15-8-9-2-1-3-11(17)6-9/h1-7,15,17H,8H2