sodium [(3-chloranyl-2-methyl-phenyl)amino]methanesulfonate

Systemtic Name: sodium [(3-chloranyl-2-methyl-phenyl)amino]methanesulfonate Openeye Name: sodium (3-chloro-2-methyl-anilino)methanesulfonate CAS Name: sodium (3-chloro-2-methylanilino)methanesulfonate IUPAC Name: sodium (3-chloro-2-methylanilino)methanesulfonate Traditional Name: sodium (3-chloro-2-methyl-anilino)methanesulfonate Formula: C8H9ClNNaO3S MolecularWeight: 257.66973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H10ClNO3S.Na/c1-6-7(9)3-2-4-8(6)10-5-14(11,12)13;/h2-4,10H,5H2,1H3,(H,11,12,13);/q;+1/p-1