1-methyl-4-(2-nitrophenoxy)pyridin-1-ium

Systemtic Name: 1-methyl-4-(2-nitrophenoxy)pyridin-1-ium Openeye Name: 1-methyl-4-(2-nitrophenoxy)pyridin-1-ium CAS Name: 1-methyl-4-(2-nitrophenoxy)pyridin-1-ium IUPAC Name: 1-methyl-4-(2-nitrophenoxy)pyridin-1-ium Traditional Name: 1-methyl-4-(2-nitrophenoxy)pyridin-1-ium Formula: C12H11N2O3+ MolecularWeight: 231.22734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)OC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)OC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H11N2O3/c1-13-8-6-10(7-9-13)17-12-5-3-2-4-11(12)14(15)16/h2-9H,1H3/q+1