[(1S)-1-benzamido-2,2,2-tris(bromanyl)ethyl]-tert-butyl-azanium

Systemtic Name: [(1S)-1-benzamido-2,2,2-tris(bromanyl)ethyl]-tert-butyl-azanium Openeye Name: [(1S)-1-benzamido-2,2,2-tribromo-ethyl]-tert-butyl-ammonium CAS Name: [(1S)-1-benzamido-2,2,2-tribromoethyl]-tert-butylammonium IUPAC Name: [(1S)-1-benzamido-2,2,2-tribromoethyl]-tert-butylazanium Traditional Name: [(1S)-1-benzamido-2,2,2-tribromo-ethyl]-tert-butyl-ammonium Formula: C13H18Br3N2O+ MolecularWeight: 458.00682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]C(C(Br)(Br)Br)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)[NH2+][C@@H](C(Br)(Br)Br)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H17Br3N2O/c1-12(2,3)18-11(13(14,15)16)17-10(19)9-7-5-4-6-8-9/h4-8,11,18H,1-3H3,(H,17,19)/p+1/t11-/m0/s1