2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(N-methylanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(N-methylanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(N-methylanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-keto-2-(N-methylanilino)ethyl]thio]propionic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)N(C)C1=CC=CC=C1

Isomeric SMILES

CC(C(=O)O)SCC(=O)N(C)C1=CC=CC=C1

InChI

InChI=1S/C12H15NO3S/c1-9(12(15)16)17-8-11(14)13(2)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,16)