3-[4-(3-ethylpiperidin-1-yl)sulfonylpyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(3-ethylpiperidin-1-yl)sulfonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[(3-ethyl-1-piperidyl)sulfonyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(3-ethyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(3-ethylpiperidin-1-yl)sulfonylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(3-ethylpiperidino)sulfonylpyrazol-1-yl]propionic acid Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)S(=O)(=O)C2=CN(N=C2)CCC(=O)O

Isomeric SMILES

CCC1CCCN(C1)S(=O)(=O)C2=CN(N=C2)CCC(=O)O

InChI

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