1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylic acid

Systemtic Name: 1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylic acid Openeye Name: 1-[2-(3-methoxyphenyl)-2-oxo-ethyl]pyridin-1-ium-3-carboxylic acid CAS Name: 1-[2-(3-methoxyphenyl)-2-oxoethyl]-3-pyridin-1-iumcarboxylic acid IUPAC Name: 1-[2-(3-methoxyphenyl)-2-oxoethyl]pyridin-1-ium-3-carboxylic acid Traditional Name: 1-[2-keto-2-(3-methoxyphenyl)ethyl]pyridin-1-ium-3-carboxylic acid Formula: C15H14NO4+ MolecularWeight: 272.27596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H13NO4/c1-20-13-6-2-4-11(8-13)14(17)10-16-7-3-5-12(9-16)15(18)19/h2-9H,10H2,1H3/p+1