7-[1-(phenylmethyl)piperazin-1-ium-1-yl]-5,6,7,8-tetrahydroquinoline

Systemtic Name: 7-[1-(phenylmethyl)piperazin-1-ium-1-yl]-5,6,7,8-tetrahydroquinoline Openeye Name: 7-(1-benzylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydroquinoline CAS Name: 7-[1-(phenylmethyl)-1-piperazin-1-iumyl]-5,6,7,8-tetrahydroquinoline IUPAC Name: 7-(1-benzylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydroquinoline Traditional Name: 7-(1-benzylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydroquinoline Formula: C20H26N3+ MolecularWeight: 308.44054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1[N+]3(CCNCC3)CC4=CC=CC=C4)N=CC=C2

Isomeric SMILES

C1CC2=C(CC1[N+]3(CCNCC3)CC4=CC=CC=C4)N=CC=C2

InChI

InChI=1S/C20H26N3/c1-2-5-17(6-3-1)16-23(13-11-21-12-14-23)19-9-8-18-7-4-10-22-20(18)15-19/h1-7,10,19,21H,8-9,11-16H2/q+1