N-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C20H22ClF3N2O2 MolecularWeight: 414.84909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C20H22ClF3N2O2/c21-16-2-1-14(6-15(16)20(22,23)24)26-17(27)10-25-18(28)19-7-11-3-12(8-19)5-13(4-11)9-19/h1-2,6,11-13H,3-5,7-10H2,(H,25,28)(H,26,27)