2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[2-(1-piperazin-4-iumyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C15H25N3+2 MolecularWeight: 247.3791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCN3CC[NH2+]CC3

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCN3CC[NH2+]CC3

InChI

InChI=1S/C15H23N3/c1-2-4-15-13-18(8-5-14(15)3-1)12-11-17-9-6-16-7-10-17/h1-4,16H,5-13H2/p+2