methyl 1-(2-pyridin-3-ylquinazolin-4-yl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(2-pyridin-3-ylquinazolin-4-yl)piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-pyridyl)quinazolin-4-yl]piperidine-4-carboxylate CAS Name: 1-[2-(3-pyridinyl)-4-quinazolinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-pyridin-3-ylquinazolin-4-yl)piperidine-4-carboxylate Traditional Name: 1-[2-(3-pyridyl)quinazolin-4-yl]isonipecotic acid methyl ester Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C20H20N4O2/c1-26-20(25)14-8-11-24(12-9-14)19-16-6-2-3-7-17(16)22-18(23-19)15-5-4-10-21-13-15/h2-7,10,13-14H,8-9,11-12H2,1H3