1-[1-[(2-bromophenyl)methyl]piperidin-4-yl]azepan-1-ium

Systemtic Name: 1-[1-[(2-bromophenyl)methyl]piperidin-4-yl]azepan-1-ium Openeye Name: 1-[1-[(2-bromophenyl)methyl]-4-piperidyl]azepan-1-ium CAS Name: 1-[1-[(2-bromophenyl)methyl]-4-piperidinyl]azepan-1-ium IUPAC Name: 1-[1-[(2-bromophenyl)methyl]piperidin-4-yl]azepan-1-ium Traditional Name: 1-[1-(2-bromobenzyl)-4-piperidyl]azepan-1-ium Formula: C18H28BrN2+ MolecularWeight: 352.33232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CCN(CC2)CC3=CC=CC=C3Br

Isomeric SMILES

C1CCC[NH+](CC1)C2CCN(CC2)CC3=CC=CC=C3Br

InChI

InChI=1S/C18H27BrN2/c19-18-8-4-3-7-16(18)15-20-13-9-17(10-14-20)21-11-5-1-2-6-12-21/h3-4,7-8,17H,1-2,5-6,9-15H2/p+1