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

Systemtic Name: potassium 1-(2-pyridin-3-ylquinazolin-4-yl)piperidine-4-carboxylate Openeye Name: potassium 1-[2-(3-pyridyl)quinazolin-4-yl]piperidine-4-carboxylate CAS Name: potassium 1-[2-(3-pyridinyl)-4-quinazolinyl]-4-piperidinecarboxylate IUPAC Name: potassium 1-(2-pyridin-3-ylquinazolin-4-yl)piperidine-4-carboxylate Traditional Name: potassium 1-[2-(3-pyridyl)quinazolin-4-yl]isonipecotate Formula: C19H17KN4O2 MolecularWeight: 372.46218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4.[K+]

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4.[K+]

InChI

InChI=1S/C19H18N4O2.K/c24-19(25)13-7-10-23(11-8-13)18-15-5-1-2-6-16(15)21-17(22-18)14-4-3-9-20-12-14;/h1-6,9,12-13H,7-8,10-11H2,(H,24,25);/q;+1/p-1