N5-(4-chloranyl-2,5-dimethoxy-phenyl)pyridin-1-ium-2,5-diamine

Systemtic Name: N5-(4-chloranyl-2,5-dimethoxy-phenyl)pyridin-1-ium-2,5-diamine Openeye Name: N5-(4-chloro-2,5-dimethoxy-phenyl)pyridin-1-ium-2,5-diamine CAS Name: N5-(4-chloro-2,5-dimethoxyphenyl)pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-(4-chloro-2,5-dimethoxyphenyl)pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-(4-chloro-2,5-dimethoxy-phenyl)amine Formula: C13H15ClN3O2+ MolecularWeight: 280.7301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=C[NH+]=C(C=C2)N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC2=C[NH+]=C(C=C2)N)OC)Cl

InChI

InChI=1S/C13H14ClN3O2/c1-18-11-6-10(12(19-2)5-9(11)14)17-8-3-4-13(15)16-7-8/h3-7,17H,1-2H3,(H2,15,16)/p+1