ethyl 1-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)-4-oxidanylidene-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 1-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)-4-oxidanylidene-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 1-[2-hydroxy-3-(1-naphthyloxy)propyl]-4-oxo-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 1-[2-hydroxy-3-(1-naphthalenyloxy)propyl]-4-oxo-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxy-3-naphthalen-1-yloxypropyl)-4-oxo-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 1-[2-hydroxy-3-(1-naphthoxy)propyl]-4-keto-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C26H22F3NO5 MolecularWeight: 485.45179

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)C(F)(F)F)CC(COC3=CC=CC4=CC=CC=C43)O

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)C(F)(F)F)CC(COC3=CC=CC4=CC=CC=C43)O

InChI

InChI=1S/C26H22F3NO5/c1-2-34-25(33)21-14-30(22-12-17(26(27,28)29)10-11-20(22)24(21)32)13-18(31)15-35-23-9-5-7-16-6-3-4-8-19(16)23/h3-12,14,18,31H,2,13,15H2,1H3