sodium [(2-methoxyphenyl)amino]methanesulfonate

Systemtic Name: sodium [(2-methoxyphenyl)amino]methanesulfonate Openeye Name: sodium (2-methoxyanilino)methanesulfonate CAS Name: sodium (2-methoxyanilino)methanesulfonate IUPAC Name: sodium (2-methoxyanilino)methanesulfonate Traditional Name: sodium o-anisidinomethanesulfonate Formula: C8H10NNaO4S MolecularWeight: 239.22407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=CC=CC=C1NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H11NO4S.Na/c1-13-8-5-3-2-4-7(8)9-6-14(10,11)12;/h2-5,9H,6H2,1H3,(H,10,11,12);/q;+1/p-1