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

Systemtic Name: (3S)-1-(1,5-dimethylpyrazol-4-yl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(1,5-dimethylpyrazole-4-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(1,5-dimethylpyrazole-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(1,5-dimethylpyrazole-4-carbonyl)nipecotate Formula: C12H16N3O3- MolecularWeight: 250.27374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3/c1-8-10(6-13-14(8)2)11(16)15-5-3-4-9(7-15)12(17)18/h6,9H,3-5,7H2,1-2H3,(H,17,18)/p-1/t9-/m0/s1