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1-[ethyl-[3-methyl-2-(1-sulfonylethyl)phenyl]amino]ethanesulfonic acid

1-[ethyl-[3-methyl-2-(1-sulfonylethyl)phenyl]amino]ethanesulfonic acid

Systemtic Name:1-[ethyl-[3-methyl-2-(1-sulfonylethyl)phenyl]amino]ethanesulfonic acid
Openeye Name:1-[N-ethyl-3-methyl-2-(1-sulfonylethyl)anilino]ethanesulfonic acid
CAS Name:1-[N-ethyl-3-methyl-2-(1-sulfonylethyl)anilino]ethanesulfonic acid
IUPAC Name:1-[N-ethyl-3-methyl-2-(1-sulfonylethyl)anilino]ethanesulfonic acid
Traditional Name:1-[N-ethyl-3-methyl-2-(1-sulfonylethyl)anilino]ethanesulfonic acid
Formula: C13H19NO5S2
MolecularWeight: 333.42366
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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1C(=S(=O)=O)C)C)C(C)S(=O)(=O)O


Isomeric SMILES

CCN(C1=CC=CC(=C1C(=S(=O)=O)C)C)C(C)S(=O)(=O)O


InChI

InChI=1S/C13H19NO5S2/c1-5-14(11(4)21(17,18)19)12-8-6-7-9(2)13(12)10(3)20(15)16/h6-8,11H,5H2,1-4H3,(H,17,18,19)


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