2-(1-thiophen-2-ylethylamino)quinoline-4-carboxylic acid

Systemtic Name: 2-(1-thiophen-2-ylethylamino)quinoline-4-carboxylic acid Openeye Name: 2-[1-(2-thienyl)ethylamino]quinoline-4-carboxylic acid CAS Name: 2-(1-thiophen-2-ylethylamino)-4-quinolinecarboxylic acid IUPAC Name: 2-(1-thiophen-2-ylethylamino)quinoline-4-carboxylic acid Traditional Name: 2-[1-(2-thienyl)ethylamino]cinchoninic acid Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CC(C1=CC=CS1)NC2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C16H14N2O2S/c1-10(14-7-4-8-21-14)17-15-9-12(16(19)20)11-5-2-3-6-13(11)18-15/h2-10H,1H3,(H,17,18)(H,19,20)