5-chloranyl-8-methyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

Systemtic Name: 5-chloranyl-8-methyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid Openeye Name: 5-chloro-8-methyl-2-(5-methyl-2-thienyl)quinoline-4-carboxylic acid CAS Name: 5-chloro-8-methyl-2-(5-methyl-2-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 5-chloro-8-methyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid Traditional Name: 5-chloro-8-methyl-2-(5-methyl-2-thienyl)cinchoninic acid Formula: C16H12ClNO2S MolecularWeight: 317.78998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)C(=CC(=N2)C3=CC=C(S3)C)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)C(=CC(=N2)C3=CC=C(S3)C)C(=O)O

InChI

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