N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-2-oxidanyl-4-phenyl-2-[4-(trifluoromethyl)phenyl]but-3-ynamide

Systemtic Name: N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-2-oxidanyl-4-phenyl-2-[4-(trifluoromethyl)phenyl]but-3-ynamide Openeye Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-phenyl-2-[4-(trifluoromethyl)phenyl]but-3-ynamide CAS Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-phenyl-2-[4-(trifluoromethyl)phenyl]-3-butynamide IUPAC Name: 2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-phenyl-2-[4-(trifluoromethyl)phenyl]but-3-ynamide Traditional Name: 2-hydroxy-N-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-4-phenyl-2-[4-(trifluoromethyl)phenyl]but-3-ynamide Formula: C26H17F3N2O4 MolecularWeight: 478.41939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(C#CC3=CC=CC=C3)(C4=CC=C(C=C4)C(F)(F)F)O

Isomeric SMILES

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(C#CC3=CC=CC=C3)(C4=CC=C(C=C4)C(F)(F)F)O

InChI

InChI=1S/C26H17F3N2O4/c1-16-22-15-20(11-12-21(22)23(32)35-31-16)30-24(33)25(34,14-13-17-5-3-2-4-6-17)18-7-9-19(10-8-18)26(27,28)29/h2-12,15,34H,1H3,(H,30,33)