dimethyl-[[4-[2-[[(3-nitropyridin-2-yl)amino]methyl]phenyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[2-[[(3-nitropyridin-2-yl)amino]methyl]phenyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[2-[[(3-nitro-2-pyridyl)amino]methyl]phenyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[2-[[(3-nitro-2-pyridinyl)amino]methyl]phenyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[2-[[(3-nitropyridin-2-yl)amino]methyl]phenyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[2-[[(3-nitro-2-pyridyl)amino]methyl]phenyl]benzyl]ammonium Formula: C21H23N4O2+ MolecularWeight: 363.43292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)C2=CC=CC=C2CNC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)C2=CC=CC=C2CNC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O2/c1-24(2)15-16-9-11-17(12-10-16)19-7-4-3-6-18(19)14-23-21-20(25(26)27)8-5-13-22-21/h3-13H,14-15H2,1-2H3,(H,22,23)/p+1