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

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-[[2-(methylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-[[2-keto-2-(methylamino)ethyl]amino]ethyl]-methyl-ammonium Formula: C13H19BrN3O2+ MolecularWeight: 329.21286

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)C[NH+](C)CC1=CC=C(C=C1)Br

Isomeric SMILES

CNC(=O)CNC(=O)C[NH+](C)CC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H18BrN3O2/c1-15-12(18)7-16-13(19)9-17(2)8-10-3-5-11(14)6-4-10/h3-6H,7-9H2,1-2H3,(H,15,18)(H,16,19)/p+1