cycloheptyl-[2-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cycloheptyl-[2-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cycloheptyl-[2-[2-morpholino-5-(trifluoromethyl)anilino]-2-oxo-ethyl]ammonium CAS Name: cycloheptyl-[2-[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-2-oxoethyl]ammonium IUPAC Name: cycloheptyl-[2-[2-morpholin-4-yl-5-(trifluoromethyl)anilino]-2-oxoethyl]azanium Traditional Name: cycloheptyl-[2-keto-2-[2-morpholino-5-(trifluoromethyl)anilino]ethyl]ammonium Formula: C20H29F3N3O2+ MolecularWeight: 400.45837

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

C1CCCC(CC1)[NH2+]CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C20H28F3N3O2/c21-20(22,23)15-7-8-18(26-9-11-28-12-10-26)17(13-15)25-19(27)14-24-16-5-3-1-2-4-6-16/h7-8,13,16,24H,1-6,9-12,14H2,(H,25,27)/p+1