ethyl 1-(1-phenyl-1,2,4-triazol-3-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(1-phenyl-1,2,4-triazol-3-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(1-phenyl-1,2,4-triazol-3-yl)piperidine-4-carboxylate CAS Name: 1-(1-phenyl-1,2,4-triazol-3-yl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-phenyl-1,2,4-triazol-3-yl)piperidine-4-carboxylate Traditional Name: 1-(1-phenyl-1,2,4-triazol-3-yl)isonipecotic acid ethyl ester Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O2/c1-2-22-15(21)13-8-10-19(11-9-13)16-17-12-20(18-16)14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3