1-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-2-carboxylic acid

Systemtic Name: 1-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-2-carboxylic acid Openeye Name: 1-[2-(4-nitrophenyl)-2-oxo-ethyl]pyridin-1-ium-2-carboxylic acid CAS Name: 1-[2-(4-nitrophenyl)-2-oxoethyl]-2-pyridin-1-iumcarboxylic acid IUPAC Name: 1-[2-(4-nitrophenyl)-2-oxoethyl]pyridin-1-ium-2-carboxylic acid Traditional Name: 1-[2-keto-2-(4-nitrophenyl)ethyl]pyridin-1-ium-2-carboxylic acid Formula: C14H11N2O5+ MolecularWeight: 287.24754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N2O5/c17-13(10-4-6-11(7-5-10)16(20)21)9-15-8-2-1-3-12(15)14(18)19/h1-8H,9H2/p+1