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sodium [(2,5-dimethylphenyl)amino]methanesulfonate

sodium [(2,5-dimethylphenyl)amino]methanesulfonate

Systemtic Name:sodium [(2,5-dimethylphenyl)amino]methanesulfonate
Openeye Name:sodium (2,5-dimethylanilino)methanesulfonate
CAS Name:sodium (2,5-dimethylanilino)methanesulfonate
IUPAC Name:sodium (2,5-dimethylanilino)methanesulfonate
Traditional Name:sodium (2,5-dimethylanilino)methanesulfonate
Formula: C9H12NNaO3S
MolecularWeight: 237.25125
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H13NO3S.Na/c1-7-3-4-8(2)9(5-7)10-6-14(11,12)13;/h3-5,10H,6H2,1-2H3,(H,11,12,13);/q;+1/p-1


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