1-azanyl-3-(hydroxymethyl)-4,4,4-tris(hydroxymethylamino)butane-1-sulfonic acid

Systemtic Name: 1-azanyl-3-(hydroxymethyl)-4,4,4-tris(hydroxymethylamino)butane-1-sulfonic acid Openeye Name: 1-amino-3-(hydroxymethyl)-4,4,4-tris(hydroxymethylamino)butane-1-sulfonic acid CAS Name: 1-amino-3-(hydroxymethyl)-4,4,4-tris(hydroxymethylamino)-1-butanesulfonic acid IUPAC Name: 1-amino-3-(hydroxymethyl)-4,4,4-tris(hydroxymethylamino)butane-1-sulfonic acid Traditional Name: 1-amino-3-methylol-4,4,4-tris(methylolamino)butane-1-sulfonic acid Formula: C8H22N4O7S MolecularWeight: 318.34788

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)C(NCO)(NCO)NCO)C(N)S(=O)(=O)O

Isomeric SMILES

C(C(CO)C(NCO)(NCO)NCO)C(N)S(=O)(=O)O

InChI

InChI=1S/C8H22N4O7S/c9-7(20(17,18)19)1-6(2-13)8(10-3-14,11-4-15)12-5-16/h6-7,10-16H,1-5,9H2,(H,17,18,19)