(3S)-1-(1-methylpyrazol-4-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(1-methylpyrazol-4-yl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(1-methylpyrazole-4-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(1-methyl-4-pyrazolyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(1-methylpyrazole-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(1-methylpyrazole-4-carbonyl)nipecotate Formula: C11H14N3O3- MolecularWeight: 236.24716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C11H15N3O3/c1-13-6-9(5-12-13)10(15)14-4-2-3-8(7-14)11(16)17/h5-6,8H,2-4,7H2,1H3,(H,16,17)/p-1/t8-/m0/s1