2-chloranyl-6,7-dimethoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-amine

Systemtic Name: 2-chloranyl-6,7-dimethoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-amine Openeye Name: 2-chloro-6,7-dimethoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-amine CAS Name: 2-chloro-6,7-dimethoxy-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-quinazolinamine IUPAC Name: 2-chloro-6,7-dimethoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-amine Traditional Name: (2-chloro-6,7-dimethoxy-quinazolin-4-yl)-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amine Formula: C21H25ClN5O2+ MolecularWeight: 414.9085

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl

InChI

InChI=1S/C21H24ClN5O2/c1-26-8-10-27(11-9-26)15-6-4-14(5-7-15)23-20-16-12-18(28-2)19(29-3)13-17(16)24-21(22)25-20/h4-7,12-13H,8-11H2,1-3H3,(H,23,24,25)/p+1