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

Systemtic Name: [2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]-5-propoxy-4-(trifluoromethyl)phenyl]carbamic acid Openeye Name: [2-[[3-oxo-3-[3-(3-pyridyl)phenyl]propanoyl]amino]-5-propoxy-4-(trifluoromethyl)phenyl]carbamic acid CAS Name: [2-[[1,3-dioxo-3-[3-(3-pyridinyl)phenyl]propyl]amino]-5-propoxy-4-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: [2-[[3-oxo-3-(3-pyridin-3-ylphenyl)propanoyl]amino]-5-propoxy-4-(trifluoromethyl)phenyl]carbamic acid Traditional Name: [2-[[3-keto-3-[3-(3-pyridyl)phenyl]propanoyl]amino]-5-propoxy-4-(trifluoromethyl)phenyl]carbamic acid Formula: C25H22F3N3O5 MolecularWeight: 501.45449

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1C(F)(F)F)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CN=CC=C3)NC(=O)O

Isomeric SMILES

CCCOC1=CC(=C(C=C1C(F)(F)F)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CN=CC=C3)NC(=O)O

InChI

InChI=1S/C25H22F3N3O5/c1-2-9-36-22-12-20(31-24(34)35)19(11-18(22)25(26,27)28)30-23(33)13-21(32)16-6-3-5-15(10-16)17-7-4-8-29-14-17/h3-8,10-12,14,31H,2,9,13H2,1H3,(H,30,33)(H,34,35)