4-sulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-sulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoic acid Openeye Name: 4-sulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoic acid CAS Name: 4-mercapto-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid IUPAC Name: 4-sulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoic acid Traditional Name: 4-mercapto-2-[(3,4,5-trimethoxybenzoyl)amino]butyric acid Formula: C14H19NO6S MolecularWeight: 329.36876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCS)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCS)C(=O)O

InChI

InChI=1S/C14H19NO6S/c1-19-10-6-8(7-11(20-2)12(10)21-3)13(16)15-9(4-5-22)14(17)18/h6-7,9,22H,4-5H2,1-3H3,(H,15,16)(H,17,18)