1-[(2-bromophenyl)methyl]-4-propan-2-yl-piperazine-1,4-diium

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-propan-2-yl-piperazine-1,4-diium Openeye Name: 1-[(2-bromophenyl)methyl]-4-isopropyl-piperazine-1,4-diium CAS Name: 1-[(2-bromophenyl)methyl]-4-propan-2-ylpiperazine-1,4-diium IUPAC Name: 1-[(2-bromophenyl)methyl]-4-propan-2-ylpiperazine-1,4-diium Traditional Name: 1-(2-bromobenzyl)-4-isopropyl-piperazine-1,4-diium Formula: C14H23BrN2+2 MolecularWeight: 299.24982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC[NH+](CC1)CC2=CC=CC=C2Br

Isomeric SMILES

CC(C)[NH+]1CC[NH+](CC1)CC2=CC=CC=C2Br

InChI

InChI=1S/C14H21BrN2/c1-12(2)17-9-7-16(8-10-17)11-13-5-3-4-6-14(13)15/h3-6,12H,7-11H2,1-2H3/p+2