3-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 3-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid Openeye Name: 3-[[4-fluoro-3-(1-piperidylsulfonyl)benzoyl]amino]propanoic acid CAS Name: 3-[[[4-fluoro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 3-[(4-fluoro-3-piperidinosulfonyl-benzoyl)amino]propionic acid Formula: C15H19FN2O5S MolecularWeight: 358.385163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC(=O)O)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC(=O)O)F

InChI

InChI=1S/C15H19FN2O5S/c16-12-5-4-11(15(21)17-7-6-14(19)20)10-13(12)24(22,23)18-8-2-1-3-9-18/h4-5,10H,1-3,6-9H2,(H,17,21)(H,19,20)