[(2R)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [(2R)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(1R)-2-(4-bromoanilino)-1-methyl-2-oxo-ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2R)-1-(4-bromoanilino)-1-oxopropan-2-yl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2R)-1-(4-bromoanilino)-1-oxopropan-2-yl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(1R)-2-(4-bromoanilino)-2-keto-1-methyl-ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C17H20BrN2O+ MolecularWeight: 348.2575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]C(C)C(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+][C@H](C)C(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H19BrN2O/c1-12(14-6-4-3-5-7-14)19-13(2)17(21)20-16-10-8-15(18)9-11-16/h3-13,19H,1-2H3,(H,20,21)/p+1/t12-,13-/m1/s1