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

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

Systemtic Name:[3-(butylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] tris(fluoranyl)methanesulfonate
Openeye Name:[3-(butylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] trifluoromethanesulfonate
CAS Name:trifluoromethanesulfonic acid [3-(butylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester
IUPAC Name:[3-(butylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] trifluoromethanesulfonate
Traditional Name:trifluoromethanesulfonic acid [3-(butylaminomethyl)-2,3-dihydro-1,4-benzodioxin-6-yl] ester
Formula: C14H18F3NO5S
MolecularWeight: 369.35663
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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1COC2=C(O1)C=C(C=C2)OS(=O)(=O)C(F)(F)F


Isomeric SMILES

CCCCNCC1COC2=C(O1)C=C(C=C2)OS(=O)(=O)C(F)(F)F


InChI

InChI=1S/C14H18F3NO5S/c1-2-3-6-18-8-11-9-21-12-5-4-10(7-13(12)22-11)23-24(19,20)14(15,16)17/h4-5,7,11,18H,2-3,6,8-9H2,1H3


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