N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-3-nitropyridin-1-ium-2-amine Traditional Name: methyl-(3-nitropyridin-1-ium-2-yl)-o-veratryl-amine Formula: C15H18N3O4+ MolecularWeight: 304.32112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)OC)OC)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C(=CC=C1)OC)OC)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4/c1-17(15-12(18(19)20)7-5-9-16-15)10-11-6-4-8-13(21-2)14(11)22-3/h4-9H,10H2,1-3H3/p+1