1-(2-hydroxyethyloxymethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-hydroxyethyloxymethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2-hydroxyethoxymethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2-hydroxyethoxymethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2-hydroxyethoxymethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-hydroxyethoxymethyl)-4-keto-quinoline-3-carboxylic acid Formula: C13H13NO5 MolecularWeight: 263.24602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CN2COCCO)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CN2COCCO)C(=O)O

InChI

InChI=1S/C13H13NO5/c15-5-6-19-8-14-7-10(13(17)18)12(16)9-3-1-2-4-11(9)14/h1-4,7,15H,5-6,8H2,(H,17,18)