6-ethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: 6-ethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: 6-ethyl-2-(5-methyl-2-thienyl)quinoline-4-carboxylate CAS Name: 6-ethyl-2-(5-methyl-2-thiophenyl)-4-quinolinecarboxylate IUPAC Name: 6-ethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxylate Traditional Name: 6-ethyl-2-(5-methyl-2-thienyl)cinchoninate Formula: C17H14NO2S- MolecularWeight: 296.36356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=C(S3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=C(S3)C

InChI

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