5-(2-piperidin-1-ylethyl)phenanthridin-5-ium bromide

Systemtic Name: 5-(2-piperidin-1-ylethyl)phenanthridin-5-ium bromide Openeye Name: 5-[2-(1-piperidyl)ethyl]phenanthridin-5-ium bromide CAS Name: 5-[2-(1-piperidinyl)ethyl]phenanthridin-5-ium bromide IUPAC Name: 5-(2-piperidin-1-ylethyl)phenanthridin-5-ium bromide Traditional Name: 5-(2-piperidinoethyl)phenanthridin-5-ium bromide Formula: C20H23BrN2 MolecularWeight: 371.31402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC[N+]2=CC3=CC=CC=C3C4=CC=CC=C42.[Br-]

Isomeric SMILES

C1CCN(CC1)CC[N+]2=CC3=CC=CC=C3C4=CC=CC=C42.[Br-]

InChI

InChI=1S/C20H23N2.BrH/c1-6-12-21(13-7-1)14-15-22-16-17-8-2-3-9-18(17)19-10-4-5-11-20(19)22;/h2-5,8-11,16H,1,6-7,12-15H2;1H/q+1;/p-1