[3-[(prop-2-enylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate

Systemtic Name: [3-[(prop-2-enylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate Openeye Name: [3-[(allylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-[(prop-2-enylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] ester IUPAC Name: [3-[(prop-2-enylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(allylamino)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl] ester Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5S/c1-3-6-14-8-11-9-17-12-5-4-10(7-13(12)18-11)19-20(2,15)16/h3-5,7,11,14H,1,6,8-9H2,2H3