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

Systemtic Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone CAS Name: [4-[(2-bromophenyl)methyl]-1-piperazin-4-iumyl]-(1-naphthalenyl)methanone IUPAC Name: [4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-(2-bromobenzyl)piperazin-4-ium-1-yl]-(1-naphthyl)methanone Formula: C22H22BrN2O+ MolecularWeight: 410.32688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H21BrN2O/c23-21-11-4-2-7-18(21)16-24-12-14-25(15-13-24)22(26)20-10-5-8-17-6-1-3-9-19(17)20/h1-11H,12-16H2/p+1