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sodium 3-[(2,3-dimethylphenyl)amino]propane-1-sulfonate

sodium 3-[(2,3-dimethylphenyl)amino]propane-1-sulfonate

Systemtic Name:sodium 3-[(2,3-dimethylphenyl)amino]propane-1-sulfonate
Openeye Name:sodium 3-(2,3-dimethylanilino)propane-1-sulfonate
CAS Name:sodium 3-(2,3-dimethylanilino)-1-propanesulfonate
IUPAC Name:sodium 3-(2,3-dimethylanilino)propane-1-sulfonate
Traditional Name:sodium 3-(2,3-dimethylanilino)propane-1-sulfonate
Formula: C11H16NNaO3S
MolecularWeight: 265.30441
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NCCCS(=O)(=O)[O-])C.[Na+]


Isomeric SMILES

CC1=C(C(=CC=C1)NCCCS(=O)(=O)[O-])C.[Na+]


InChI

InChI=1S/C11H17NO3S.Na/c1-9-5-3-6-11(10(9)2)12-7-4-8-16(13,14)15;/h3,5-6,12H,4,7-8H2,1-2H3,(H,13,14,15);/q;+1/p-1


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