(2-morpholin-4-yl-1-benzofuran-5-yl) 3-methoxy-3-methyl-butane-1-sulfonate

Systemtic Name: (2-morpholin-4-yl-1-benzofuran-5-yl) 3-methoxy-3-methyl-butane-1-sulfonate Openeye Name: (2-morpholinobenzofuran-5-yl) 3-methoxy-3-methyl-butane-1-sulfonate CAS Name: 3-methoxy-3-methyl-1-butanesulfonic acid IUPAC Name: (2-morpholin-4-yl-1-benzofuran-5-yl) 3-methoxy-3-methylbutane-1-sulfonate Traditional Name: 3-methoxy-3-methyl-butane-1-sulfonic acid (2-morpholinobenzofuran-5-yl) ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCS(=O)(=O)OC1=CC2=C(C=C1)OC(=C2)N3CCOCC3)OC

Isomeric SMILES

CC(C)(CCS(=O)(=O)OC1=CC2=C(C=C1)OC(=C2)N3CCOCC3)OC

InChI

InChI=1S/C18H25NO6S/c1-18(2,22-3)6-11-26(20,21)25-15-4-5-16-14(12-15)13-17(24-16)19-7-9-23-10-8-19/h4-5,12-13H,6-11H2,1-3H3