1-adamantyl-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-ethyl]ammonium Formula: C19H23ClF3N2O+ MolecularWeight: 387.84693

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C19H22ClF3N2O/c20-16-2-1-14(6-15(16)19(21,22)23)25-17(26)10-24-18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,11-13,24H,3-5,7-10H2,(H,25,26)/p+1