(2-azanyl-2-oxidanylidene-ethyl) 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (2-amino-2-keto-ethyl) ester Formula: C16H12N2O3S MolecularWeight: 312.34308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N

InChI

InChI=1S/C16H12N2O3S/c17-15(19)9-21-16(20)11-8-13(14-6-3-7-22-14)18-12-5-2-1-4-10(11)12/h1-8H,9H2,(H2,17,19)