1-[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]piperidine-4-carboxylate

Systemtic Name: 1-[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]piperidine-4-carboxylate Openeye Name: 1-[2-[(dimethylammonio)methyl]quinazolin-4-yl]piperidine-4-carboxylate CAS Name: 1-[2-[(dimethylammonio)methyl]-4-quinazolinyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[2-[(dimethylammonio)methyl]quinazolin-4-yl]isonipecotate Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)N3CCC(CC3)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)N3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C17H22N4O2/c1-20(2)11-15-18-14-6-4-3-5-13(14)16(19-15)21-9-7-12(8-10-21)17(22)23/h3-6,12H,7-11H2,1-2H3,(H,22,23)