(3S)-1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidine-3-carboxylate Openeye Name: (3S)-1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[1-oxo-3-(1,2,4-triazol-1-yl)propyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-(1,2,4-triazol-1-yl)propanoyl]nipecotate Formula: C11H15N4O3- MolecularWeight: 251.2618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCN2C=NC=N2)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCN2C=NC=N2)C(=O)[O-]

InChI

InChI=1S/C11H16N4O3/c16-10(3-5-15-8-12-7-13-15)14-4-1-2-9(6-14)11(17)18/h7-9H,1-6H2,(H,17,18)/p-1/t9-/m0/s1