(4-bromophenyl)methyl-methyl-[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[(2S)-1-(4-methylanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[(2S)-1-(4-methylanilino)-1-oxopropan-2-yl]azanium Traditional Name: (4-bromobenzyl)-[(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl]-methyl-ammonium Formula: C18H22BrN2O+ MolecularWeight: 362.28408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)[NH+](C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+](C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H21BrN2O/c1-13-4-10-17(11-5-13)20-18(22)14(2)21(3)12-15-6-8-16(19)9-7-15/h4-11,14H,12H2,1-3H3,(H,20,22)/p+1/t14-/m0/s1