6-chloranyl-2-(2,5-dimethylthiophen-3-yl)-8-methyl-quinoline-4-carboxylic acid

Systemtic Name: 6-chloranyl-2-(2,5-dimethylthiophen-3-yl)-8-methyl-quinoline-4-carboxylic acid Openeye Name: 6-chloro-2-(2,5-dimethyl-3-thienyl)-8-methyl-quinoline-4-carboxylic acid CAS Name: 6-chloro-2-(2,5-dimethyl-3-thiophenyl)-8-methyl-4-quinolinecarboxylic acid IUPAC Name: 6-chloro-2-(2,5-dimethylthiophen-3-yl)-8-methylquinoline-4-carboxylic acid Traditional Name: 6-chloro-2-(2,5-dimethyl-3-thienyl)-8-methyl-cinchoninic acid Formula: C17H14ClNO2S MolecularWeight: 331.81656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)C

InChI

InChI=1S/C17H14ClNO2S/c1-8-4-11(18)6-13-14(17(20)21)7-15(19-16(8)13)12-5-9(2)22-10(12)3/h4-7H,1-3H3,(H,20,21)