6,7-dimethoxy-3-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-one Openeye Name: 6,7-dimethoxy-3-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-quinazolinone IUPAC Name: 6,7-dimethoxy-3-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-one Traditional Name: 6,7-dimethoxy-3-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinazolin-4-one Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)N3C=NC4=CC(=C(C=C4C3=O)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)N3C=NC4=CC(=C(C=C4C3=O)OC)OC

InChI

InChI=1S/C21H24N4O3/c1-23-8-10-24(11-9-23)15-4-6-16(7-5-15)25-14-22-18-13-20(28-3)19(27-2)12-17(18)21(25)26/h4-7,12-14H,8-11H2,1-3H3/p+1