2-(5-chloranylthiophen-2-yl)-8-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-8-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-chloro-2-thienyl)-8-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(5-chloro-2-thiophenyl)-8-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5-chlorothiophen-2-yl)-8-ethylquinoline-4-carboxylic acid Traditional Name: 2-(5-chloro-2-thienyl)-8-ethyl-cinchoninic acid Formula: C16H12ClNO2S MolecularWeight: 317.78998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC=C(S3)Cl

Isomeric SMILES

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H12ClNO2S/c1-2-9-4-3-5-10-11(16(19)20)8-12(18-15(9)10)13-6-7-14(17)21-13/h3-8H,2H2,1H3,(H,19,20)