N-methyl-5-nitro-N-phenethyl-pyridin-1-ium-2-amine

Systemtic Name: N-methyl-5-nitro-N-phenethyl-pyridin-1-ium-2-amine Openeye Name: N-methyl-5-nitro-N-phenethyl-pyridin-1-ium-2-amine CAS Name: N-methyl-5-nitro-N-phenethyl-2-pyridin-1-iumamine IUPAC Name: N-methyl-5-nitro-N-phenethylpyridin-1-ium-2-amine Traditional Name: methyl-(5-nitropyridin-1-ium-2-yl)-phenethyl-amine Formula: C14H16N3O2+ MolecularWeight: 258.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=[NH+]C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=[NH+]C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O2/c1-16(10-9-12-5-3-2-4-6-12)14-8-7-13(11-15-14)17(18)19/h2-8,11H,9-10H2,1H3/p+1