[(2S)-1-[[2,6-di(propan-2-yl)phenyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[2,6-di(propan-2-yl)phenyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-(2,6-diisopropylanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[2,6-di(propan-2-yl)anilino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[2,6-di(propan-2-yl)anilino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-(2,6-diisopropylanilino)-2-keto-ethyl]ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C21H28N2O/c1-14(2)17-11-8-12-18(15(3)4)20(17)23-21(24)19(22)13-16-9-6-5-7-10-16/h5-12,14-15,19H,13,22H2,1-4H3,(H,23,24)/p+1/t19-/m0/s1