1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol Openeye Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol CAS Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-methylsulfonylphenoxy)-2-propanol IUPAC Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol Traditional Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-3-(4-mesylphenoxy)propan-2-ol Formula: C19H23NO7S MolecularWeight: 409.45342

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)OCC(CNCCOC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)OCC(CNCCOC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C19H23NO7S/c1-28(22,23)17-5-2-15(3-6-17)25-12-14(21)11-20-8-9-24-16-4-7-18-19(10-16)27-13-26-18/h2-7,10,14,20-21H,8-9,11-13H2,1H3