4-morpholin-4-yl-4-oxidanylidene-2-[(phenylmethyl)sulfonylmethyl]butanoic acid

Systemtic Name: 4-morpholin-4-yl-4-oxidanylidene-2-[(phenylmethyl)sulfonylmethyl]butanoic acid Openeye Name: 2-(benzylsulfonylmethyl)-4-morpholino-4-oxo-butanoic acid CAS Name: 4-(4-morpholinyl)-4-oxo-2-[(phenylmethyl)sulfonylmethyl]butanoic acid IUPAC Name: 2-(benzylsulfonylmethyl)-4-morpholin-4-yl-4-oxobutanoic acid Traditional Name: 2-(benzylsulfonylmethyl)-4-keto-4-morpholino-butyric acid Formula: C16H21NO6S MolecularWeight: 355.40604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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