4-(4-phenylbut-3-yn-2-ylidene)morpholin-4-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 4-(4-phenylbut-3-yn-2-ylidene)morpholin-4-ium; tris(fluoranyl)methanesulfonate Openeye Name: 4-(1-methyl-3-phenyl-prop-2-ynylidene)morpholin-4-ium; trifluoromethanesulfonate CAS Name: 4-(4-phenylbut-3-yn-2-ylidene)morpholin-4-ium; trifluoromethanesulfonate IUPAC Name: 4-(4-phenylbut-3-yn-2-ylidene)morpholin-4-ium; trifluoromethanesulfonate Traditional Name: 4-(1-methyl-3-phenyl-prop-2-ynylidene)morpholin-4-ium triflate Formula: C15H16F3NO4S MolecularWeight: 363.35205

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[N+]1CCOCC1)C#CC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(=[N+]1CCOCC1)C#CC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H16NO.CHF3O3S/c1-13(15-9-11-16-12-10-15)7-8-14-5-3-2-4-6-14;2-1(3,4)8(5,6)7/h2-6H,9-12H2,1H3;(H,5,6,7)/q+1;/p-1