[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(phenylmethyl)azanium

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-(3-bromoanilino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: [2-(3-bromoanilino)-2-oxoethyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-(3-bromoanilino)-2-oxoethyl]-ethylazanium Traditional Name: benzyl-[2-(3-bromoanilino)-2-keto-ethyl]-ethyl-ammonium Formula: C17H20BrN2O+ MolecularWeight: 348.2575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H19BrN2O/c1-2-20(12-14-7-4-3-5-8-14)13-17(21)19-16-10-6-9-15(18)11-16/h3-11H,2,12-13H2,1H3,(H,19,21)/p+1