2-[(2-fluoranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[(2-fluoranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid Openeye Name: 2-[[2-fluoro-5-(1-piperidylsulfonyl)benzoyl]amino]propanoic acid CAS Name: 2-[[[2-fluoro-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(2-fluoro-5-piperidin-1-ylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 2-[(2-fluoro-5-piperidinosulfonyl-benzoyl)amino]propionic acid Formula: C15H19FN2O5S MolecularWeight: 358.385163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)F

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)F

InChI

InChI=1S/C15H19FN2O5S/c1-10(15(20)21)17-14(19)12-9-11(5-6-13(12)16)24(22,23)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,17,19)(H,20,21)