[4-methyl-2-[[3-oxidanylidene-3-(3-pyridin-4-ylphenyl)propanoyl]amino]-5-(trifluoromethyl)phenyl]carbamic acid

Systemtic Name: [4-methyl-2-[[3-oxidanylidene-3-(3-pyridin-4-ylphenyl)propanoyl]amino]-5-(trifluoromethyl)phenyl]carbamic acid Openeye Name: [4-methyl-2-[[3-oxo-3-[3-(4-pyridyl)phenyl]propanoyl]amino]-5-(trifluoromethyl)phenyl]carbamic acid CAS Name: [2-[[1,3-dioxo-3-(3-pyridin-4-ylphenyl)propyl]amino]-4-methyl-5-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: [4-methyl-2-[[3-oxo-3-(3-pyridin-4-ylphenyl)propanoyl]amino]-5-(trifluoromethyl)phenyl]carbamic acid Traditional Name: [2-[[3-keto-3-[3-(4-pyridyl)phenyl]propanoyl]amino]-4-methyl-5-(trifluoromethyl)phenyl]carbamic acid Formula: C23H18F3N3O4 MolecularWeight: 457.40193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(F)(F)F)NC(=O)O)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CC=NC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C(F)(F)F)NC(=O)O)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CC=NC=C3

InChI

InChI=1S/C23H18F3N3O4/c1-13-9-18(19(29-22(32)33)11-17(13)23(24,25)26)28-21(31)12-20(30)16-4-2-3-15(10-16)14-5-7-27-8-6-14/h2-11,29H,12H2,1H3,(H,28,31)(H,32,33)