2-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-yl]amine Formula: C19H21ClN5+ MolecularWeight: 354.85654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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