4-azanyl-1-phosphono-butane-1-sulfonic acid

Systemtic Name: 4-azanyl-1-phosphono-butane-1-sulfonic acid Openeye Name: 4-amino-1-phosphono-butane-1-sulfonic acid CAS Name: 4-amino-1-phosphono-1-butanesulfonic acid IUPAC Name: 4-amino-1-phosphonobutane-1-sulfonic acid Traditional Name: 4-amino-1-phosphono-butane-1-sulfonic acid Formula: C4H12NO6PS MolecularWeight: 233.179941

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(P(=O)(O)O)S(=O)(=O)O)CN

Isomeric SMILES

C(CC(P(=O)(O)O)S(=O)(=O)O)CN

InChI

InChI=1S/C4H12NO6PS/c5-3-1-2-4(12(6,7)8)13(9,10)11/h4H,1-3,5H2,(H2,6,7,8)(H,9,10,11)