2-(2,5-dimethylthiophen-3-yl)-8-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2,5-dimethylthiophen-3-yl)-8-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dimethyl-3-thienyl)-8-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(2,5-dimethyl-3-thiophenyl)-8-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dimethylthiophen-3-yl)-8-ethylquinoline-4-carboxylic acid Traditional Name: 2-(2,5-dimethyl-3-thienyl)-8-ethyl-cinchoninic acid Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=C(SC(=C3)C)C

Isomeric SMILES

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C18H17NO2S/c1-4-12-6-5-7-13-15(18(20)21)9-16(19-17(12)13)14-8-10(2)22-11(14)3/h5-9H,4H2,1-3H3,(H,20,21)