sodium [(4-butoxyphenyl)amino]methanesulfonate

Systemtic Name: sodium [(4-butoxyphenyl)amino]methanesulfonate Openeye Name: sodium (4-butoxyanilino)methanesulfonate CAS Name: sodium (4-butoxyanilino)methanesulfonate IUPAC Name: sodium (4-butoxyanilino)methanesulfonate Traditional Name: sodium (4-butoxyanilino)methanesulfonate Formula: C11H16NNaO4S MolecularWeight: 281.30381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H17NO4S.Na/c1-2-3-8-16-11-6-4-10(5-7-11)12-9-17(13,14)15;/h4-7,12H,2-3,8-9H2,1H3,(H,13,14,15);/q;+1/p-1