2-butyl-3-oxidanylidene-4H-quinoxaline-5-carboxylic acid

Systemtic Name: 2-butyl-3-oxidanylidene-4H-quinoxaline-5-carboxylic acid Openeye Name: 2-butyl-3-oxo-4H-quinoxaline-5-carboxylic acid CAS Name: 2-butyl-3-oxo-4H-quinoxaline-5-carboxylic acid IUPAC Name: 2-butyl-3-oxo-4H-quinoxaline-5-carboxylic acid Traditional Name: 2-butyl-3-keto-4H-quinoxaline-5-carboxylic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2NC1=O)C(=O)O

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2NC1=O)C(=O)O

InChI

InChI=1S/C13H14N2O3/c1-2-3-6-10-12(16)15-11-8(13(17)18)5-4-7-9(11)14-10/h4-5,7H,2-3,6H2,1H3,(H,15,16)(H,17,18)