2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxylate Openeye Name: 2-(5-ethyl-2-thienyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(5-ethyl-2-thiophenyl)-8-methyl-4-quinolinecarboxylate IUPAC Name: 2-(5-ethylthiophen-2-yl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(5-ethyl-2-thienyl)-8-methyl-cinchoninate Formula: C17H14NO2S- MolecularWeight: 296.36356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)[O-]

InChI

InChI=1S/C17H15NO2S/c1-3-11-7-8-15(21-11)14-9-13(17(19)20)12-6-4-5-10(2)16(12)18-14/h4-9H,3H2,1-2H3,(H,19,20)/p-1