3-[4-methoxy-2-(trifluoromethyl)quinolin-6-yl]prop-2-ynyl thiophene-2-carboxylate

Systemtic Name: 3-[4-methoxy-2-(trifluoromethyl)quinolin-6-yl]prop-2-ynyl thiophene-2-carboxylate Openeye Name: 3-[4-methoxy-2-(trifluoromethyl)-6-quinolyl]prop-2-ynyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid 3-[4-methoxy-2-(trifluoromethyl)-6-quinolinyl]prop-2-ynyl ester IUPAC Name: 3-[4-methoxy-2-(trifluoromethyl)quinolin-6-yl]prop-2-ynyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid 3-[4-methoxy-2-(trifluoromethyl)-6-quinolyl]prop-2-ynyl ester Formula: C19H12F3NO3S MolecularWeight: 391.36369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=C1C=C(C=C2)C#CCOC(=O)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

COC1=CC(=NC2=C1C=C(C=C2)C#CCOC(=O)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C19H12F3NO3S/c1-25-15-11-17(19(20,21)22)23-14-7-6-12(10-13(14)15)4-2-8-26-18(24)16-5-3-9-27-16/h3,5-7,9-11H,8H2,1H3