1-(1-butan-2-ylimidazol-4-yl)sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(1-butan-2-ylimidazol-4-yl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(1-sec-butylimidazol-4-yl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[(1-butan-2-yl-4-imidazolyl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(1-butan-2-ylimidazol-4-yl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(1-sec-butylimidazol-4-yl)sulfonylnipecotic acid Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(N=C1)S(=O)(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCC(C)N1C=C(N=C1)S(=O)(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C13H21N3O4S/c1-3-10(2)15-8-12(14-9-15)21(19,20)16-6-4-5-11(7-16)13(17)18/h8-11H,3-7H2,1-2H3,(H,17,18)