3-[(4-bromophenyl)carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(4-bromophenyl)carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(4-bromobenzoyl)amino]propyl]-methyl-ammonium CAS Name: 3-[[(4-bromophenyl)-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(4-bromobenzoyl)amino]propyl]-methylazanium Traditional Name: benzyl-[3-[(4-bromobenzoyl)amino]propyl]-methyl-ammonium Formula: C18H22BrN2O+ MolecularWeight: 362.28408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O/c1-21(14-15-6-3-2-4-7-15)13-5-12-20-18(22)16-8-10-17(19)11-9-16/h2-4,6-11H,5,12-14H2,1H3,(H,20,22)/p+1