methyl 2-[(2,6-dimethylphenyl)-(2-sulfinooxybutanoyl)amino]propanoate

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)-(2-sulfinooxybutanoyl)amino]propanoate Openeye Name: methyl 2-[2,6-dimethyl-N-(2-sulfinooxybutanoyl)anilino]propanoate CAS Name: 2-(2,6-dimethyl-N-(1-oxo-2-sulfinooxybutyl)anilino)propanoic acid methyl ester IUPAC Name: methyl 2-[2,6-dimethyl-N-(2-sulfinooxybutanoyl)anilino]propanoate Traditional Name: 2-[2,6-dimethyl-N-(2-sulfinooxybutanoyl)anilino]propionic acid methyl ester Formula: C16H23NO6S MolecularWeight: 357.42192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)OS(=O)O

Isomeric SMILES

CCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)OS(=O)O

InChI

InChI=1S/C16H23NO6S/c1-6-13(23-24(20)21)15(18)17(12(4)16(19)22-5)14-10(2)8-7-9-11(14)3/h7-9,12-13H,6H2,1-5H3,(H,20,21)