[(2R)-1-[[4-azanyl-3-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-1-[[4-azanyl-3-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-methyl-propan-2-yl-azanium Openeye Name: [(1R)-2-[4-amino-3-(trifluoromethyl)anilino]-1-methyl-2-oxo-ethyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-1-[4-amino-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-1-[4-amino-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl]-methyl-propan-2-ylazanium Traditional Name: [(1R)-2-[4-amino-3-(trifluoromethyl)anilino]-2-keto-1-methyl-ethyl]-isopropyl-methyl-ammonium Formula: C14H21F3N3O+ MolecularWeight: 304.33125

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)C(C)C(=O)NC1=CC(=C(C=C1)N)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)N)C(F)(F)F)[NH+](C)C(C)C

InChI

InChI=1S/C14H20F3N3O/c1-8(2)20(4)9(3)13(21)19-10-5-6-12(18)11(7-10)14(15,16)17/h5-9H,18H2,1-4H3,(H,19,21)/p+1/t9-/m1/s1