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

Systemtic Name: 4-(3,4-dihydro-2H-quinolin-1-yl)-6-[(4-phenethylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazin-2-amine Openeye Name: 4-(3,4-dihydro-2H-quinolin-1-yl)-6-[(4-phenethylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazin-2-amine CAS Name: 4-(3,4-dihydro-2H-quinolin-1-yl)-6-[(4-phenethyl-1-piperazine-1,4-diiumyl)methyl]-1,3,5-triazin-2-amine IUPAC Name: 4-(3,4-dihydro-2H-quinolin-1-yl)-6-[(4-phenethylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazin-2-amine Traditional Name: [4-(3,4-dihydro-2H-quinolin-1-yl)-6-[(4-phenethylpiperazine-1,4-diium-1-yl)methyl]-s-triazin-2-yl]amine Formula: C25H33N7+2 MolecularWeight: 431.57642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=NC(=NC(=N3)C[NH+]4CC[NH+](CC4)CCC5=CC=CC=C5)N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=NC(=NC(=N3)C[NH+]4CC[NH+](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+2