[3-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate

Systemtic Name: [3-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate Openeye Name: [3-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester IUPAC Name: [3-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-(pyrrolidinomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)OCC(O2)CN3CCCC3

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)OCC(O2)CN3CCCC3

InChI

InChI=1S/C14H19NO5S/c1-21(16,17)20-11-4-5-13-14(8-11)19-12(10-18-13)9-15-6-2-3-7-15/h4-5,8,12H,2-3,6-7,9-10H2,1H3