(3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) methanesulfonate

Systemtic Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) methanesulfonate Openeye Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-benzofuran-5-yl) methanesulfonate CAS Name: methanesulfonic acid [3,3-dimethyl-2-(1-pyrrolidinyl)-2H-benzofuran-5-yl] ester IUPAC Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) methanesulfonate Traditional Name: methanesulfonic acid (3,3-dimethyl-2-pyrrolidino-coumaran-5-yl) ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)N3CCCC3)C

Isomeric SMILES

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)N3CCCC3)C

InChI

InChI=1S/C15H21NO4S/c1-15(2)12-10-11(20-21(3,17)18)6-7-13(12)19-14(15)16-8-4-5-9-16/h6-7,10,14H,4-5,8-9H2,1-3H3