methyl 3-[2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-[2-oxo-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[1-oxo-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[2-keto-5-(trifluoromethyl)-1-pyridyl]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C18H17F3N2O4 MolecularWeight: 382.33379

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=C(C=CC2=O)C(F)(F)F

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=C(C=CC2=O)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O4/c1-27-17(26)9-14(12-5-3-2-4-6-12)22-15(24)11-23-10-13(18(19,20)21)7-8-16(23)25/h2-8,10,14H,9,11H2,1H3,(H,22,24)