2-[2-(3,4,5-trimethoxyphenyl)carbonylsulfanylpropanoylamino]ethanoic acid

Systemtic Name: 2-[2-(3,4,5-trimethoxyphenyl)carbonylsulfanylpropanoylamino]ethanoic acid Openeye Name: 2-[2-(3,4,5-trimethoxybenzoyl)sulfanylpropanoylamino]acetic acid CAS Name: 2-[[1-oxo-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]thio]propyl]amino]acetic acid IUPAC Name: 2-[2-(3,4,5-trimethoxybenzoyl)sulfanylpropanoylamino]acetic acid Traditional Name: 2-[2-[(3,4,5-trimethoxybenzoyl)thio]propanoylamino]acetic acid Formula: C15H19NO7S MolecularWeight: 357.37886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)O)SC(=O)C1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CC(C(=O)NCC(=O)O)SC(=O)C1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C15H19NO7S/c1-8(14(19)16-7-12(17)18)24-15(20)9-5-10(21-2)13(23-4)11(6-9)22-3/h5-6,8H,7H2,1-4H3,(H,16,19)(H,17,18)