1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylate

Systemtic Name: 1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylate Openeye Name: 1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylate CAS Name: 1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-4-piperidinecarboxylate IUPAC Name: 1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylate Traditional Name: 1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)isonipecotate Formula: C17H16N5O2- MolecularWeight: 322.34124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=CC(=NC3=NC=NN23)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=CC(=NC3=NC=NN23)C4=CC=CC=C4

InChI

InChI=1S/C17H17N5O2/c23-16(24)13-6-8-21(9-7-13)15-10-14(12-4-2-1-3-5-12)20-17-18-11-19-22(15)17/h1-5,10-11,13H,6-9H2,(H,23,24)/p-1