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

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-6-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-chloro-2-thienyl)-6-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(5-chloro-2-thiophenyl)-6-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5-chlorothiophen-2-yl)-6-ethylquinoline-4-carboxylic acid Traditional Name: 2-(5-chloro-2-thienyl)-6-ethyl-cinchoninic acid Formula: C16H12ClNO2S MolecularWeight: 317.78998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(S3)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(S3)Cl

InChI

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