sodium 1-azanyl-3-oxidanylidene-icosane-2-sulfonic acid

Systemtic Name: sodium 1-azanyl-3-oxidanylidene-icosane-2-sulfonic acid Openeye Name: sodium 1-amino-3-oxo-icosane-2-sulfonic acid CAS Name: sodium 1-amino-3-oxo-2-eicosanesulfonic acid IUPAC Name: sodium 1-amino-3-oxoicosane-2-sulfonic acid Traditional Name: sodium 1-amino-3-keto-eicosane-2-sulfonic acid Formula: C20H41NNaO4S+ MolecularWeight: 414.59861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(CN)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(CN)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C20H41NO4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)20(18-21)26(23,24)25;/h20H,2-18,21H2,1H3,(H,23,24,25);/q;+1