2-[5-(3-ethylpiperidin-1-yl)sulfonylthiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-(3-ethylpiperidin-1-yl)sulfonylthiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[(3-ethyl-1-piperidyl)sulfonyl]-2-thienyl]acetic acid CAS Name: 2-[5-[(3-ethyl-1-piperidinyl)sulfonyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-(3-ethylpiperidin-1-yl)sulfonylthiophen-2-yl]acetic acid Traditional Name: 2-[5-(3-ethylpiperidino)sulfonyl-2-thienyl]acetic acid Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)O

Isomeric SMILES

CCC1CCCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)O

InChI

InChI=1S/C13H19NO4S2/c1-2-10-4-3-7-14(9-10)20(17,18)13-6-5-11(19-13)8-12(15)16/h5-6,10H,2-4,7-9H2,1H3,(H,15,16)