N,N'-bis[3-(phenethylamino)propyl]heptane-1,7-diamine tetrahydrochloride

Systemtic Name: N,N'-bis[3-(phenethylamino)propyl]heptane-1,7-diamine tetrahydrochloride Openeye Name: N,N'-bis[3-(phenethylamino)propyl]heptane-1,7-diamine tetrahydrochloride CAS Name: N,N'-bis[3-(phenethylamino)propyl]heptane-1,7-diamine tetrahydrochloride IUPAC Name: N,N'-bis[3-(phenethylamino)propyl]heptane-1,7-diamine tetrahydrochloride Traditional Name: phenethyl-[3-[7-[3-(phenethylamino)propylamino]heptylamino]propyl]amine tetrahydrochloride Formula: C29H52Cl4N4 MolecularWeight: 598.56198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCCCNCCCCCCCNCCCNCCC2=CC=CC=C2.Cl.Cl.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNCCCNCCCCCCCNCCCNCCC2=CC=CC=C2.Cl.Cl.Cl.Cl

InChI

InChI=1S/C29H48N4.4ClH/c1(2-10-20-30-22-12-24-32-26-18-28-14-6-4-7-15-28)3-11-21-31-23-13-25-33-27-19-29-16-8-5-9-17-29;;;;/h4-9,14-17,30-33H,1-3,10-13,18-27H2;4*1H