methyl 1-[2-(1,2,4-triazol-1-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(1,2,4-triazol-1-yl)propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(1,2,4-triazol-1-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(1,2,4-triazol-1-yl)propyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,2,4-triazol-1-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(1,2,4-triazol-1-yl)propanoyl]isonipecotic acid methyl ester Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)OC)N2C=NC=N2

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)OC)N2C=NC=N2

InChI

InChI=1S/C12H18N4O3/c1-9(16-8-13-7-14-16)11(17)15-5-3-10(4-6-15)12(18)19-2/h7-10H,3-6H2,1-2H3