2-[(3,5-diethoxy-4-oxidanyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(3,5-diethoxy-4-oxidanyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(3,5-diethoxy-4-hydroxy-benzoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(3,5-diethoxy-4-hydroxyphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3,5-diethoxy-4-hydroxybenzoyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(3,5-diethoxy-4-hydroxy-benzoyl)amino]-4-(methylthio)butyric acid Formula: C16H23NO6S MolecularWeight: 357.42192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)OCC)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1O)OCC)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C16H23NO6S/c1-4-22-12-8-10(9-13(14(12)18)23-5-2)15(19)17-11(16(20)21)6-7-24-3/h8-9,11,18H,4-7H2,1-3H3,(H,17,19)(H,20,21)