2-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[4-(2-chlorophenyl)-1-piperazin-1-iumyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-yl]amine Formula: C19H21ClN5+ MolecularWeight: 354.85654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H20ClN5/c20-15-6-2-4-8-17(15)25-11-9-24(10-12-25)13-18-22-16-7-3-1-5-14(16)19(21)23-18/h1-8H,9-13H2,(H2,21,22,23)/p+1