6-bromanyl-2-(5-chloranylthiophen-2-yl)-3-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-(5-chloranylthiophen-2-yl)-3-ethyl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-(5-chloro-2-thienyl)-3-ethyl-quinoline-4-carboxylic acid CAS Name: 6-bromo-2-(5-chloro-2-thiophenyl)-3-ethyl-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-(5-chlorothiophen-2-yl)-3-ethylquinoline-4-carboxylic acid Traditional Name: 6-bromo-2-(5-chloro-2-thienyl)-3-ethyl-cinchoninic acid Formula: C16H11BrClNO2S MolecularWeight: 396.68604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=C(S3)Cl

Isomeric SMILES

CCC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H11BrClNO2S/c1-2-9-14(16(20)21)10-7-8(17)3-4-11(10)19-15(9)12-5-6-13(18)22-12/h3-7H,2H2,1H3,(H,20,21)