N-[(4-methoxyphenyl)methyl]-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(4-methoxyphenyl)methyl]-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(4-methoxyphenyl)methyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(4-methoxyphenyl)methyl]-3-nitropyridin-1-ium-2-amine Traditional Name: (3-nitropyridin-1-ium-2-yl)-p-anisyl-amine Formula: C13H14N3O3+ MolecularWeight: 260.26856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3/c1-19-11-6-4-10(5-7-11)9-15-13-12(16(17)18)3-2-8-14-13/h2-8H,9H2,1H3,(H,14,15)/p+1