N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-quinazolin-4-amine

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-quinazolin-4-amine Openeye Name: N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-quinazolin-4-amine CAS Name: N-(2,4-dimethoxyphenyl)-2-(1-piperazin-4-iumyl)-4-quinazolinamine IUPAC Name: N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-ylquinazolin-4-amine Traditional Name: (2,4-dimethoxyphenyl)-(2-piperazin-4-ium-1-ylquinazolin-4-yl)amine Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)N4CC[NH2+]CC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)N4CC[NH2+]CC4)OC

InChI

InChI=1S/C20H23N5O2/c1-26-14-7-8-17(18(13-14)27-2)22-19-15-5-3-4-6-16(15)23-20(24-19)25-11-9-21-10-12-25/h3-8,13,21H,9-12H2,1-2H3,(H,22,23,24)/p+1