2-(5-ethylthiophen-2-yl)-3,6-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-ethylthiophen-2-yl)-3,6-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-ethyl-2-thienyl)-3,6-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(5-ethyl-2-thiophenyl)-3,6-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5-ethylthiophen-2-yl)-3,6-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(5-ethyl-2-thienyl)-3,6-dimethyl-cinchoninic acid Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)O)C

Isomeric SMILES

CCC1=CC=C(S1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)O)C

InChI

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