1-ethyl-1-oxidanidyl-4-oxidanylidene-7-pyridin-4-yl-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-ethyl-1-oxidanidyl-4-oxidanylidene-7-pyridin-4-yl-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-ethyl-1-oxido-4-oxo-7-(4-pyridyl)quinolin-1-ium-3-carboxylic acid CAS Name: 1-ethyl-1-oxido-4-oxo-7-pyridin-4-yl-3-quinolin-1-iumcarboxylic acid IUPAC Name: 1-ethyl-1-oxido-4-oxo-7-pyridin-4-ylquinolin-1-ium-3-carboxylic acid Traditional Name: 1-ethyl-4-keto-1-oxido-7-(4-pyridyl)quinolin-1-ium-3-carboxylic acid Formula: C17H14N2O4 MolecularWeight: 310.30406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O)[O-]

Isomeric SMILES

CC[N+]1(C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-2-19(23)10-14(17(21)22)16(20)13-4-3-12(9-15(13)19)11-5-7-18-8-6-11/h3-10H,2H2,1H3,(H,21,22)