3-methylbut-2-enyl-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium

Systemtic Name: 3-methylbut-2-enyl-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium Openeye Name: 3-methylbut-2-enyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]ammonium CAS Name: 3-methylbut-2-enyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]ammonium IUPAC Name: 3-methylbut-2-enyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium Traditional Name: [(3R)-5-keto-1-[2-(trifluoromethyl)benzyl]pyrrolidin-3-yl]-(3-methylbut-2-enyl)ammonium Formula: C17H22F3N2O+ MolecularWeight: 327.36459

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[NH2+]C1CC(=O)N(C1)CC2=CC=CC=C2C(F)(F)F)C

Isomeric SMILES

CC(=CC[NH2+][C@@H]1CC(=O)N(C1)CC2=CC=CC=C2C(F)(F)F)C

InChI

InChI=1S/C17H21F3N2O/c1-12(2)7-8-21-14-9-16(23)22(11-14)10-13-5-3-4-6-15(13)17(18,19)20/h3-7,14,21H,8-11H2,1-2H3/p+1/t14-/m1/s1