2-(2-methyl-1,3-benzodioxol-2-yl)-2-(1-morpholin-4-ylethoxy)butanoic acid

Systemtic Name: 2-(2-methyl-1,3-benzodioxol-2-yl)-2-(1-morpholin-4-ylethoxy)butanoic acid Openeye Name: 2-(2-methyl-1,3-benzodioxol-2-yl)-2-(1-morpholinoethoxy)butanoic acid CAS Name: 2-(2-methyl-1,3-benzodioxol-2-yl)-2-[1-(4-morpholinyl)ethoxy]butanoic acid IUPAC Name: 2-(2-methyl-1,3-benzodioxol-2-yl)-2-(1-morpholin-4-ylethoxy)butanoic acid Traditional Name: 2-(2-methyl-1,3-benzodioxol-2-yl)-2-(1-morpholinoethoxy)butyric acid Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)(C1(OC2=CC=CC=C2O1)C)OC(C)N3CCOCC3

Isomeric SMILES

CCC(C(=O)O)(C1(OC2=CC=CC=C2O1)C)OC(C)N3CCOCC3

InChI

InChI=1S/C18H25NO6/c1-4-18(16(20)21,23-13(2)19-9-11-22-12-10-19)17(3)24-14-7-5-6-8-15(14)25-17/h5-8,13H,4,9-12H2,1-3H3,(H,20,21)