N',N'-dihexyl-N-isoquinolin-1-yl-propane-1,3-diamine hydrochloride

Systemtic Name: N',N'-dihexyl-N-isoquinolin-1-yl-propane-1,3-diamine hydrochloride Openeye Name: N',N'-dihexyl-N-(1-isoquinolyl)propane-1,3-diamine hydrochloride CAS Name: N',N'-dihexyl-N-(1-isoquinolinyl)propane-1,3-diamine hydrochloride IUPAC Name: N',N'-dihexyl-N-isoquinolin-1-ylpropane-1,3-diamine hydrochloride Traditional Name: dihexyl-[3-(1-isoquinolylamino)propyl]amine hydrochloride Formula: C24H40ClN3 MolecularWeight: 406.0475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)CCCNC1=NC=CC2=CC=CC=C21.Cl

Isomeric SMILES

CCCCCCN(CCCCCC)CCCNC1=NC=CC2=CC=CC=C21.Cl

InChI

InChI=1S/C24H39N3.ClH/c1-3-5-7-11-19-27(20-12-8-6-4-2)21-13-17-25-24-23-15-10-9-14-22(23)16-18-26-24;/h9-10,14-16,18H,3-8,11-13,17,19-21H2,1-2H3,(H,25,26);1H