2-(2,5-dimethylthiophen-3-yl)-5,7-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2,5-dimethylthiophen-3-yl)-5,7-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dimethyl-3-thienyl)-5,7-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(2,5-dimethyl-3-thiophenyl)-5,7-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dimethylthiophen-3-yl)-5,7-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(2,5-dimethyl-3-thienyl)-5,7-dimethyl-cinchoninic acid Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3=C(SC(=C3)C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3=C(SC(=C3)C)C)C(=O)O)C

InChI

InChI=1S/C18H17NO2S/c1-9-5-10(2)17-14(18(20)21)8-15(19-16(17)6-9)13-7-11(3)22-12(13)4/h5-8H,1-4H3,(H,20,21)