N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-4-(4-methoxyphenyl)-2-oxidanyl-but-3-ynamide

Systemtic Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-4-(4-methoxyphenyl)-2-oxidanyl-but-3-ynamide Openeye Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-2-hydroxy-4-(4-methoxyphenyl)but-3-ynamide CAS Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-2-hydroxy-4-(4-methoxyphenyl)-3-butynamide IUPAC Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-2-hydroxy-4-(4-methoxyphenyl)but-3-ynamide Traditional Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-cyclopentyl-2-hydroxy-4-(4-methoxyphenyl)but-3-ynamide Formula: C24H21F3N2O3 MolecularWeight: 442.43035

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC(C2CCCC2)(C(=O)NC3=CC(=C(C=C3)C#N)C(F)(F)F)O

Isomeric SMILES

COC1=CC=C(C=C1)C#CC(C2CCCC2)(C(=O)NC3=CC(=C(C=C3)C#N)C(F)(F)F)O

InChI

InChI=1S/C24H21F3N2O3/c1-32-20-10-6-16(7-11-20)12-13-23(31,18-4-2-3-5-18)22(30)29-19-9-8-17(15-28)21(14-19)24(25,26)27/h6-11,14,18,31H,2-5H2,1H3,(H,29,30)