4-azanyl-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]-2-nitro-benzamide chloride

Systemtic Name: 4-azanyl-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]-2-nitro-benzamide chloride Openeye Name: 4-amino-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]-2-nitro-benzamide chloride CAS Name: 4-amino-N-[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]-2-nitrobenzamide chloride IUPAC Name: 4-amino-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]-2-nitrobenzamide chloride Traditional Name: 4-amino-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]-2-nitro-benzamide chloride Formula: C19H18ClN5O3 MolecularWeight: 399.83092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)N)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)N)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C19H17N5O3.ClH/c1-23-10-8-16(9-11-23)21-14-3-5-15(6-4-14)22-19(25)17-7-2-13(20)12-18(17)24(26)27;/h2-12H,1H3,(H3,20,22,25);1H