4-(4-methylpiperazin-4-ium-1-yl)quinazoline-7-carboxylate

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)quinazoline-7-carboxylate Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)quinazoline-7-carboxylate CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-7-quinazolinecarboxylate IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)quinazoline-7-carboxylate Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)quinazoline-7-carboxylate Formula: C14H16N4O2 MolecularWeight: 272.30244

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=NC3=C2C=CC(=C3)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=NC3=C2C=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C14H16N4O2/c1-17-4-6-18(7-5-17)13-11-3-2-10(14(19)20)8-12(11)15-9-16-13/h2-3,8-9H,4-7H2,1H3,(H,19,20)