[3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: [3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester IUPAC Name: [3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [3-(propylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester Formula: C13H16F3NO5S MolecularWeight: 355.33005

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1COC2=C(O1)C=C(C=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCNCC1COC2=C(O1)C=C(C=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H16F3NO5S/c1-2-5-17-7-10-8-20-11-4-3-9(6-12(11)21-10)22-23(18,19)13(14,15)16/h3-4,6,10,17H,2,5,7-8H2,1H3