sodium 3-[ethyl-(3-methylcyclohexyl)amino]propane-1-sulfonate

Systemtic Name: sodium 3-[ethyl-(3-methylcyclohexyl)amino]propane-1-sulfonate Openeye Name: sodium 3-[ethyl-(3-methylcyclohexyl)amino]propane-1-sulfonate CAS Name: sodium 3-[ethyl-(3-methylcyclohexyl)amino]-1-propanesulfonate IUPAC Name: sodium 3-[ethyl-(3-methylcyclohexyl)amino]propane-1-sulfonate Traditional Name: sodium 3-[ethyl-(3-methylcyclohexyl)amino]propane-1-sulfonate Formula: C12H24NNaO3S MolecularWeight: 285.37863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCS(=O)(=O)[O-])C1CCCC(C1)C.[Na+]

Isomeric SMILES

CCN(CCCS(=O)(=O)[O-])C1CCCC(C1)C.[Na+]

InChI

InChI=1S/C12H25NO3S.Na/c1-3-13(8-5-9-17(14,15)16)12-7-4-6-11(2)10-12;/h11-12H,3-10H2,1-2H3,(H,14,15,16);/q;+1/p-1