6-ethoxy-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid

Systemtic Name: 6-ethoxy-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid Openeye Name: 6-ethoxy-2-(5-ethyl-2-thienyl)quinoline-4-carboxylic acid CAS Name: 6-ethoxy-2-(5-ethyl-2-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-ethoxy-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid Traditional Name: 6-ethoxy-2-(5-ethyl-2-thienyl)cinchoninic acid Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)OCC)C(=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)OCC)C(=C2)C(=O)O

InChI

InChI=1S/C18H17NO3S/c1-3-12-6-8-17(23-12)16-10-14(18(20)21)13-9-11(22-4-2)5-7-15(13)19-16/h5-10H,3-4H2,1-2H3,(H,20,21)