6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine

Systemtic Name: 6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine Openeye Name: 6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine CAS Name: 6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethyl-1-piperazinyl)methyl]-1,3,5-triazin-1-ium-2-amine IUPAC Name: 6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine Traditional Name: [6-(3,4-dihydro-2H-quinolin-1-yl)-4-[(4-phenethylpiperazino)methyl]-s-triazin-1-ium-2-yl]amine Formula: C25H32N7+ MolecularWeight: 430.56848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=[NH+]C(=NC(=N3)CN4CCN(CC4)CCC5=CC=CC=C5)N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=[NH+]C(=NC(=N3)CN4CCN(CC4)CCC5=CC=CC=C5)N

InChI

InChI=1S/C25H31N7/c26-24-27-23(28-25(29-24)32-13-6-10-21-9-4-5-11-22(21)32)19-31-17-15-30(16-18-31)14-12-20-7-2-1-3-8-20/h1-5,7-9,11H,6,10,12-19H2,(H2,26,27,28,29)/p+1