2-[4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]quinazolin-2-yl]phenolate

Systemtic Name: 2-[4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]quinazolin-2-yl]phenolate Openeye Name: 2-[4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]quinazolin-2-yl]phenolate CAS Name: 2-[4-[4-(2-methoxyphenyl)-1-piperazin-4-iumyl]-2-quinazolinyl]phenolate IUPAC Name: 2-[4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]quinazolin-2-yl]phenolate Traditional Name: 2-[4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]quinazolin-2-yl]phenolate Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5[O-]

Isomeric SMILES

COC1=CC=CC=C1[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5[O-]

InChI

InChI=1S/C25H24N4O2/c1-31-23-13-7-5-11-21(23)28-14-16-29(17-15-28)25-18-8-2-4-10-20(18)26-24(27-25)19-9-3-6-12-22(19)30/h2-13,30H,14-17H2,1H3