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

Systemtic Name: [6-methoxy-4-[2-(propylcarbamoylamino)ethyl]naphthalen-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [6-methoxy-4-[2-(propylcarbamoylamino)ethyl]-2-naphthyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [6-methoxy-4-[2-[[oxo(propylamino)methyl]amino]ethyl]-2-naphthalenyl] ester IUPAC Name: [6-methoxy-4-[2-(propylcarbamoylamino)ethyl]naphthalen-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [6-methoxy-4-[2-(propylcarbamoylamino)ethyl]-2-naphthyl] ester Formula: C18H21F3N2O5S MolecularWeight: 434.42995

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21F3N2O5S/c1-3-7-22-17(24)23-8-6-13-10-15(28-29(25,26)18(19,20)21)9-12-4-5-14(27-2)11-16(12)13/h4-5,9-11H,3,6-8H2,1-2H3,(H2,22,23,24)