potassium 7-bromanyl-2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: potassium 7-bromanyl-2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: potassium 7-bromo-2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: potassium 7-bromo-2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylate IUPAC Name: potassium 7-bromo-2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: potassium 7-bromo-2-(5-chloro-2-thienyl)cinchoninate Formula: C14H6BrClKNO2S MolecularWeight: 406.72324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)N=C(C=C2C(=O)[O-])C3=CC=C(S3)Cl.[K+]

Isomeric SMILES

C1=CC2=C(C=C1Br)N=C(C=C2C(=O)[O-])C3=CC=C(S3)Cl.[K+]

InChI

InChI=1S/C14H7BrClNO2S.K/c15-7-1-2-8-9(14(18)19)6-11(17-10(8)5-7)12-3-4-13(16)20-12;/h1-6H,(H,18,19);/q;+1/p-1