isoquinolino[2,1-a]quinolin-5-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: isoquinolino[2,1-a]quinolin-5-ium; tris(fluoranyl)methanesulfonate Openeye Name: isoquinolino[2,1-a]quinolin-5-ium; trifluoromethanesulfonate CAS Name: isoquinolino[2,1-a]quinolin-5-ium; trifluoromethanesulfonate IUPAC Name: isoquinolino[2,1-a]quinolin-5-ium; trifluoromethanesulfonate Traditional Name: isoquinolino[2,1-a]quinolin-5-ium triflate Formula: C18H12F3NO3S MolecularWeight: 379.35299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C[N+]3=C2C=CC4=CC=CC=C43.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C[N+]3=C2C=CC4=CC=CC=C43.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H12N.CHF3O3S/c1-3-7-15-13(5-1)11-12-18-16-8-4-2-6-14(16)9-10-17(15)18;2-1(3,4)8(5,6)7/h1-12H;(H,5,6,7)/q+1;/p-1