(2R)-2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoic acid

Systemtic Name: (2R)-2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylpropanoic acid Openeye Name: (2R)-2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: (2R)-2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfonylpropanoic acid IUPAC Name: (2R)-2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfonylpropanoic acid Traditional Name: (2R)-2-[2-(3,4-dimethoxyanilino)-2-keto-ethyl]sulfonylpropionic acid Formula: C13H17NO7S MolecularWeight: 331.34158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)CC(=O)NC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

C[C@H](C(=O)O)S(=O)(=O)CC(=O)NC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C13H17NO7S/c1-8(13(16)17)22(18,19)7-12(15)14-9-4-5-10(20-2)11(6-9)21-3/h4-6,8H,7H2,1-3H3,(H,14,15)(H,16,17)/t8-/m1/s1