(3S)-1-(1,3,5-trimethylpyrazol-4-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(1,3,5-trimethylpyrazol-4-yl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(1,3,5-trimethylpyrazole-4-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[oxo-(1,3,5-trimethyl-4-pyrazolyl)methyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(1,3,5-trimethylpyrazole-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(1,3,5-trimethylpyrazole-4-carbonyl)nipecotate Formula: C13H18N3O3- MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C13H19N3O3/c1-8-11(9(2)15(3)14-8)12(17)16-6-4-5-10(7-16)13(18)19/h10H,4-7H2,1-3H3,(H,18,19)/p-1/t10-/m0/s1