2-(4-bromanylphenoxy)ethyl-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[2-(4-bromophenoxy)ethyl]-methyl-ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(4-bromophenoxy)ethyl]-methylammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(4-bromophenoxy)ethyl]-methylazanium Traditional Name: [(1R)-2-anilino-2-keto-1-methyl-ethyl]-[2-(4-bromophenoxy)ethyl]-methyl-ammonium Formula: C18H22BrN2O2+ MolecularWeight: 378.28348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H21BrN2O2/c1-14(18(22)20-16-6-4-3-5-7-16)21(2)12-13-23-17-10-8-15(19)9-11-17/h3-11,14H,12-13H2,1-2H3,(H,20,22)/p+1/t14-/m1/s1