[3-(2-acetamidoethyl)-5-methoxy-1-benzothiophen-6-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [3-(2-acetamidoethyl)-5-methoxy-1-benzothiophen-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: [3-(2-acetamidoethyl)-5-methoxy-benzothiophen-6-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [3-(2-acetamidoethyl)-5-methoxy-1-benzothiophen-6-yl] ester IUPAC Name: [3-(2-acetamidoethyl)-5-methoxy-1-benzothiophen-6-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [3-(2-acetamidoethyl)-5-methoxy-benzothiophen-6-yl] ester Formula: C14H14F3NO5S2 MolecularWeight: 397.38987

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CSC2=CC(=C(C=C21)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(=O)NCCC1=CSC2=CC(=C(C=C21)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H14F3NO5S2/c1-8(19)18-4-3-9-7-24-13-6-12(11(22-2)5-10(9)13)23-25(20,21)14(15,16)17/h5-7H,3-4H2,1-2H3,(H,18,19)