(4-bromophenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-(4-nitroanilino)ethyl]-methyl-ammonium Formula: C16H17BrN3O3+ MolecularWeight: 379.22848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrN3O3/c1-19(10-12-2-4-13(17)5-3-12)11-16(21)18-14-6-8-15(9-7-14)20(22)23/h2-9H,10-11H2,1H3,(H,18,21)/p+1