3-sulfanyl-2-[(3,4,5-triethoxyphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-sulfanyl-2-[(3,4,5-triethoxyphenyl)carbonylamino]propanoic acid Openeye Name: 3-sulfanyl-2-[(3,4,5-triethoxybenzoyl)amino]propanoic acid CAS Name: 3-mercapto-2-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]propanoic acid IUPAC Name: 3-sulfanyl-2-[(3,4,5-triethoxybenzoyl)amino]propanoic acid Traditional Name: 3-mercapto-2-[(3,4,5-triethoxybenzoyl)amino]propionic acid Formula: C16H23NO6S MolecularWeight: 357.42192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(CS)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(CS)C(=O)O

InChI

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