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

Systemtic Name: 2-[2-[ethyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(N-ethylanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(N-ethylanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(N-ethylanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(N-ethylanilino)-2-keto-ethyl]thio]propionic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSC(C)C(=O)O

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSC(C)C(=O)O

InChI

InChI=1S/C13H17NO3S/c1-3-14(11-7-5-4-6-8-11)12(15)9-18-10(2)13(16)17/h4-8,10H,3,9H2,1-2H3,(H,16,17)