[6-methoxy-4-[2-(methylcarbamoylamino)ethyl]naphthalen-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [6-methoxy-4-[2-(methylcarbamoylamino)ethyl]naphthalen-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [6-methoxy-4-[2-(methylcarbamoylamino)ethyl]-2-naphthyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [6-methoxy-4-[2-(methylcarbamoylamino)ethyl]-2-naphthalenyl] ester IUPAC Name: [6-methoxy-4-[2-(methylcarbamoylamino)ethyl]naphthalen-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [6-methoxy-4-[2-(methylcarbamoylamino)ethyl]-2-naphthyl] ester Formula: C16H17F3N2O5S MolecularWeight: 406.37679

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NCCC1=C2C=C(C=CC2=CC(=C1)OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

CNC(=O)NCCC1=C2C=C(C=CC2=CC(=C1)OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C16H17F3N2O5S/c1-20-15(22)21-6-5-11-8-13(26-27(23,24)16(17,18)19)7-10-3-4-12(25-2)9-14(10)11/h3-4,7-9H,5-6H2,1-2H3,(H2,20,21,22)