sodium 4-(2-azanylphenoxy)butane-1-sulfonate

Systemtic Name: sodium 4-(2-azanylphenoxy)butane-1-sulfonate Openeye Name: sodium 4-(2-aminophenoxy)butane-1-sulfonate CAS Name: sodium 4-(2-aminophenoxy)-1-butanesulfonate IUPAC Name: sodium 4-(2-aminophenoxy)butane-1-sulfonate Traditional Name: sodium 4-(2-aminophenoxy)butane-1-sulfonate Formula: C10H14NNaO4S MolecularWeight: 267.27723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)OCCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)N)OCCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H15NO4S.Na/c11-9-5-1-2-6-10(9)15-7-3-4-8-16(12,13)14;/h1-2,5-6H,3-4,7-8,11H2,(H,12,13,14);/q;+1/p-1