[4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone CAS Name: [4-[(2-bromophenyl)methyl]-1-piperazin-4-iumyl]-(3-methoxyphenyl)methanone IUPAC Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [4-(2-bromobenzyl)piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Formula: C19H22BrN2O2+ MolecularWeight: 390.29418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3Br

InChI

InChI=1S/C19H21BrN2O2/c1-24-17-7-4-6-15(13-17)19(23)22-11-9-21(10-12-22)14-16-5-2-3-8-18(16)20/h2-8,13H,9-12,14H2,1H3/p+1