cyclohexyl-[(2S)-2-oxidanyl-3-[2-(trifluoromethyl)benzimidazol-1-yl]propyl]azanium

Systemtic Name: cyclohexyl-[(2S)-2-oxidanyl-3-[2-(trifluoromethyl)benzimidazol-1-yl]propyl]azanium Openeye Name: cyclohexyl-[(2S)-2-hydroxy-3-[2-(trifluoromethyl)benzimidazol-1-yl]propyl]ammonium CAS Name: cyclohexyl-[(2S)-2-hydroxy-3-[2-(trifluoromethyl)-1-benzimidazolyl]propyl]ammonium IUPAC Name: cyclohexyl-[(2S)-2-hydroxy-3-[2-(trifluoromethyl)benzimidazol-1-yl]propyl]azanium Traditional Name: cyclohexyl-[(2S)-2-hydroxy-3-[2-(trifluoromethyl)benzimidazol-1-yl]propyl]ammonium Formula: C17H23F3N3O+ MolecularWeight: 342.37923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]CC(CN2C3=CC=CC=C3N=C2C(F)(F)F)O

Isomeric SMILES

C1CCC(CC1)[NH2+]C[C@@H](CN2C3=CC=CC=C3N=C2C(F)(F)F)O

InChI

InChI=1S/C17H22F3N3O/c18-17(19,20)16-22-14-8-4-5-9-15(14)23(16)11-13(24)10-21-12-6-2-1-3-7-12/h4-5,8-9,12-13,21,24H,1-3,6-7,10-11H2/p+1/t13-/m0/s1