ethyl 6-(3-methanoylpyrrol-1-yl)-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(3-methanoylpyrrol-1-yl)-2-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-(3-formylpyrrol-1-yl)-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 6-(3-formyl-1-pyrrolyl)-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-formylpyrrol-1-yl)-2-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 6-(3-formylpyrrol-1-yl)-2-keto-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H13F3N2O4 MolecularWeight: 378.30203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC(=C(C=C2NC1=O)C(F)(F)F)N3C=CC(=C3)C=O

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=C(C=C2NC1=O)C(F)(F)F)N3C=CC(=C3)C=O

InChI

InChI=1S/C18H13F3N2O4/c1-2-27-17(26)12-5-11-6-15(23-4-3-10(8-23)9-24)13(18(19,20)21)7-14(11)22-16(12)25/h3-9H,2H2,1H3,(H,22,25)