3-[2-[(3-morpholin-4-yl-3-oxidanylidene-propyl)sulfonylmethyl]phenyl]propanoic acid

Systemtic Name: 3-[2-[(3-morpholin-4-yl-3-oxidanylidene-propyl)sulfonylmethyl]phenyl]propanoic acid Openeye Name: 3-[2-[(3-morpholino-3-oxo-propyl)sulfonylmethyl]phenyl]propanoic acid CAS Name: 3-[2-[[3-(4-morpholinyl)-3-oxopropyl]sulfonylmethyl]phenyl]propanoic acid IUPAC Name: 3-[2-[(3-morpholin-4-yl-3-oxopropyl)sulfonylmethyl]phenyl]propanoic acid Traditional Name: 3-[2-[(3-keto-3-morpholino-propyl)sulfonylmethyl]phenyl]propionic acid Formula: C17H23NO6S MolecularWeight: 369.43262

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCS(=O)(=O)CC2=CC=CC=C2CCC(=O)O

Isomeric SMILES

C1COCCN1C(=O)CCS(=O)(=O)CC2=CC=CC=C2CCC(=O)O

InChI

InChI=1S/C17H23NO6S/c19-16(18-8-10-24-11-9-18)7-12-25(22,23)13-15-4-2-1-3-14(15)5-6-17(20)21/h1-4H,5-13H2,(H,20,21)