[3-[[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]amino]-2-oxidanyl-propyl]sulfamic acid

Systemtic Name: [3-[[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]amino]-2-oxidanyl-propyl]sulfamic acid Openeye Name: [2-hydroxy-3-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]propyl]sulfamic acid CAS Name: [2-hydroxy-3-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]propyl]sulfamic acid IUPAC Name: [2-hydroxy-3-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]propyl]sulfamic acid Traditional Name: [2-hydroxy-3-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]propyl]sulfamic acid Formula: C13H22N2O7S MolecularWeight: 350.38798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(CNCC(CNS(=O)(=O)O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)OCC(CNCC(CNS(=O)(=O)O)O)O

InChI

InChI=1S/C13H22N2O7S/c1-21-12-2-4-13(5-3-12)22-9-11(17)7-14-6-10(16)8-15-23(18,19)20/h2-5,10-11,14-17H,6-9H2,1H3,(H,18,19,20)