5-(4-ethoxy-2-methylsulfonyloxy-4-oxidanylidene-butyl)-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylic acid

Systemtic Name: 5-(4-ethoxy-2-methylsulfonyloxy-4-oxidanylidene-butyl)-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylic acid Openeye Name: 4-benzyl-5-(4-ethoxy-2-methylsulfonyloxy-4-oxo-butyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid CAS Name: 5-(4-ethoxy-2-methylsulfonyloxy-4-oxobutyl)-2,2-dimethyl-4-(phenylmethyl)-3-oxazolidinecarboxylic acid IUPAC Name: 4-benzyl-5-(4-ethoxy-2-methylsulfonyloxy-4-oxobutyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid Traditional Name: 4-benzyl-5-(4-ethoxy-4-keto-2-methylsulfonyloxy-butyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid Formula: C20H29NO8S MolecularWeight: 443.51116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1C(N(C(O1)(C)C)C(=O)O)CC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CC(CC1C(N(C(O1)(C)C)C(=O)O)CC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C20H29NO8S/c1-5-27-18(22)13-15(29-30(4,25)26)12-17-16(11-14-9-7-6-8-10-14)21(19(23)24)20(2,3)28-17/h6-10,15-17H,5,11-13H2,1-4H3,(H,23,24)