sodium 2-hexylpyrrole-1-sulfonate

Systemtic Name: sodium 2-hexylpyrrole-1-sulfonate Openeye Name: sodium 2-hexylpyrrole-1-sulfonate CAS Name: sodium 2-hexyl-1-pyrrolesulfonate IUPAC Name: sodium 2-hexylpyrrole-1-sulfonate Traditional Name: sodium 2-hexylpyrrole-1-sulfonate Formula: C10H16NNaO3S MolecularWeight: 253.29371

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CN1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCC1=CC=CN1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H17NO3S.Na/c1-2-3-4-5-7-10-8-6-9-11(10)15(12,13)14;/h6,8-9H,2-5,7H2,1H3,(H,12,13,14);/q;+1/p-1