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

Systemtic Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)quinazolin-2-yl]phenolate Openeye Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)quinazolin-2-yl]phenolate CAS Name: 2-[4-(4-ethyl-1-piperazin-4-iumyl)-2-quinazolinyl]phenolate IUPAC Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)quinazolin-2-yl]phenolate Traditional Name: 2-[4-(4-ethylpiperazin-4-ium-1-yl)quinazolin-2-yl]phenolate Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4[O-]

InChI

InChI=1S/C20H22N4O/c1-2-23-11-13-24(14-12-23)20-15-7-3-5-9-17(15)21-19(22-20)16-8-4-6-10-18(16)25/h3-10,25H,2,11-14H2,1H3