2-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonylquinazolin-4-olate

Systemtic Name: 2-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonylquinazolin-4-olate Openeye Name: 2-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]quinazolin-4-olate CAS Name: 2-[[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]-oxomethyl]-4-quinazolinolate IUPAC Name: 2-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]quinazolin-4-olate Traditional Name: 2-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]quinazolin-4-olate Formula: C19H19N5O2 MolecularWeight: 349.38646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C19H19N5O2/c1-13-5-4-8-16(20-13)23-9-11-24(12-10-23)19(26)17-21-15-7-3-2-6-14(15)18(25)22-17/h2-8H,9-12H2,1H3,(H,21,22,25)