(1-ethoxy-1-oxidanylidene-hexan-2-yl)-triphenyl-arsanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (1-ethoxy-1-oxidanylidene-hexan-2-yl)-triphenyl-arsanium; tris(fluoranyl)methanesulfonate Openeye Name: 1-ethoxycarbonylpentyl(triphenyl)arsonium; trifluoromethanesulfonate CAS Name: (1-ethoxy-1-oxohexan-2-yl)-triphenylarsonium; trifluoromethanesulfonate IUPAC Name: (1-ethoxy-1-oxohexan-2-yl)-triphenylarsanium; trifluoromethanesulfonate Traditional Name: 1-carbethoxypentyl(triphenyl)arsonium triflate Formula: C27H30AsF3O5S MolecularWeight: 598.50591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)[As+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCC(C(=O)OCC)[As+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C26H30AsO2.CHF3O3S/c1-3-5-21-25(26(28)29-4-2)27(22-15-9-6-10-16-22,23-17-11-7-12-18-23)24-19-13-8-14-20-24;2-1(3,4)8(5,6)7/h6-20,25H,3-5,21H2,1-2H3;(H,5,6,7)/q+1;/p-1