3-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-(4-acetamidophenyl)sulfonylpiperidine-4-carbonyl]amino]propanoic acid CAS Name: 3-[[[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-(4-acetamidophenyl)sulfonylpiperidine-4-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-(4-acetamidophenyl)sulfonylisonipecotoyl]amino]propionic acid Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC(=O)O

InChI

InChI=1S/C17H23N3O6S/c1-12(21)19-14-2-4-15(5-3-14)27(25,26)20-10-7-13(8-11-20)17(24)18-9-6-16(22)23/h2-5,13H,6-11H2,1H3,(H,18,24)(H,19,21)(H,22,23)