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

Systemtic Name: (4-bromophenyl)methyl-[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-keto-ethyl]-methyl-ammonium Formula: C15H21BrN3O+ MolecularWeight: 339.25074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrN3O/c1-15(2,11-17)19(4)14(20)10-18(3)9-12-5-7-13(16)8-6-12/h5-8H,9-10H2,1-4H3/p+1