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

Systemtic Name: 2-[(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonylmethyl]-3-phenyl-propanoic acid Openeye Name: 2-benzyl-3-(2-morpholino-2-oxo-ethyl)sulfonyl-propanoic acid CAS Name: 2-[[2-(4-morpholinyl)-2-oxoethyl]sulfonylmethyl]-3-phenylpropanoic acid IUPAC Name: 2-benzyl-3-(2-morpholin-4-yl-2-oxoethyl)sulfonylpropanoic acid Traditional Name: 2-benzyl-3-(2-keto-2-morpholino-ethyl)sulfonyl-propionic acid Formula: C16H21NO6S MolecularWeight: 355.40604

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CS(=O)(=O)CC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1COCCN1C(=O)CS(=O)(=O)CC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO6S/c18-15(17-6-8-23-9-7-17)12-24(21,22)11-14(16(19)20)10-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,19,20)