2-[methanoyl-(5-methyl-2-oxidanyl-phenyl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[methanoyl-(5-methyl-2-oxidanyl-phenyl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-(N-formyl-2-hydroxy-5-methyl-anilino)-4-methylsulfanyl-butanoic acid CAS Name: 2-(N-formyl-2-hydroxy-5-methylanilino)-4-(methylthio)butanoic acid IUPAC Name: 2-(N-formyl-2-hydroxy-5-methylanilino)-4-methylsulfanylbutanoic acid Traditional Name: 2-(N-formyl-2-hydroxy-5-methyl-anilino)-4-(methylthio)butyric acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)N(C=O)C(CCSC)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)O)N(C=O)C(CCSC)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-9-3-4-12(16)11(7-9)14(8-15)10(13(17)18)5-6-19-2/h3-4,7-8,10,16H,5-6H2,1-2H3,(H,17,18)