3-(3-piperidin-1-ylsulfonylphenyl)propanoic acid

Systemtic Name: 3-(3-piperidin-1-ylsulfonylphenyl)propanoic acid Openeye Name: 3-[3-(1-piperidylsulfonyl)phenyl]propanoic acid CAS Name: 3-[3-(1-piperidinylsulfonyl)phenyl]propanoic acid IUPAC Name: 3-(3-piperidin-1-ylsulfonylphenyl)propanoic acid Traditional Name: 3-(3-piperidinosulfonylphenyl)propionic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)CCC(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)CCC(=O)O

InChI

InChI=1S/C14H19NO4S/c16-14(17)8-7-12-5-4-6-13(11-12)20(18,19)15-9-2-1-3-10-15/h4-6,11H,1-3,7-10H2,(H,16,17)