5-bromanyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: 5-bromanyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: 5-bromo-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 5-bromo-2-thiophen-2-yl-4-quinolinecarboxylate IUPAC Name: 5-bromo-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 5-bromo-2-(2-thienyl)cinchoninate Formula: C14H7BrNO2S- MolecularWeight: 333.17988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)[O-]

InChI

InChI=1S/C14H8BrNO2S/c15-9-3-1-4-10-13(9)8(14(17)18)7-11(16-10)12-5-2-6-19-12/h1-7H,(H,17,18)/p-1