(2S)-1-(4-carboxy-2-methyl-pyrazol-3-yl)carbonylpiperidine-2-carboxylic acid

Systemtic Name: (2S)-1-(4-carboxy-2-methyl-pyrazol-3-yl)carbonylpiperidine-2-carboxylic acid Openeye Name: (2S)-1-(4-carboxy-2-methyl-pyrazole-3-carbonyl)piperidine-2-carboxylic acid CAS Name: (2S)-1-[(4-carboxy-2-methyl-3-pyrazolyl)-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: (2S)-1-(4-carboxy-2-methylpyrazole-3-carbonyl)piperidine-2-carboxylic acid Traditional Name: (2S)-1-(4-carboxy-2-methyl-pyrazole-3-carbonyl)pipecolinic acid Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)N2CCCCC2C(=O)O

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)N2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C12H15N3O5/c1-14-9(7(6-13-14)11(17)18)10(16)15-5-3-2-4-8(15)12(19)20/h6,8H,2-5H2,1H3,(H,17,18)(H,19,20)/t8-/m0/s1