sodium 2-[2-ethylsulfanylethyl(phenyl)amino]propanoate

Systemtic Name: sodium 2-[2-ethylsulfanylethyl(phenyl)amino]propanoate Openeye Name: sodium 2-[N-(2-ethylsulfanylethyl)anilino]propanoate CAS Name: sodium 2-[N-[2-(ethylthio)ethyl]anilino]propanoate IUPAC Name: sodium 2-[N-(2-ethylsulfanylethyl)anilino]propanoate Traditional Name: sodium 2-[N-[2-(ethylthio)ethyl]anilino]propionate Formula: C13H18NNaO2S MolecularWeight: 275.34229

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN(C1=CC=CC=C1)C(C)C(=O)[O-].[Na+]

Isomeric SMILES

CCSCCN(C1=CC=CC=C1)C(C)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H19NO2S.Na/c1-3-17-10-9-14(11(2)13(15)16)12-7-5-4-6-8-12;/h4-8,11H,3,9-10H2,1-2H3,(H,15,16);/q;+1/p-1