N-[1-[2-(2-methoxyphenyl)piperazin-1-yl]propyl]isoquinolin-1-amine hydrobromide

Systemtic Name: N-[1-[2-(2-methoxyphenyl)piperazin-1-yl]propyl]isoquinolin-1-amine hydrobromide Openeye Name: N-[1-[2-(2-methoxyphenyl)piperazin-1-yl]propyl]isoquinolin-1-amine hydrobromide CAS Name: N-[1-[2-(2-methoxyphenyl)-1-piperazinyl]propyl]-1-isoquinolinamine hydrobromide IUPAC Name: N-[1-[2-(2-methoxyphenyl)piperazin-1-yl]propyl]isoquinolin-1-amine hydrobromide Traditional Name: 1-isoquinolyl-[1-[2-(2-methoxyphenyl)piperazino]propyl]amine hydrobromide Formula: C23H29BrN4O MolecularWeight: 457.40656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1=NC=CC2=CC=CC=C21)N3CCNCC3C4=CC=CC=C4OC.Br

Isomeric SMILES

CCC(NC1=NC=CC2=CC=CC=C21)N3CCNCC3C4=CC=CC=C4OC.Br

InChI

InChI=1S/C23H28N4O.BrH/c1-3-22(26-23-18-9-5-4-8-17(18)12-13-25-23)27-15-14-24-16-20(27)19-10-6-7-11-21(19)28-2;/h4-13,20,22,24H,3,14-16H2,1-2H3,(H,25,26);1H