dimethyl-(3-phenylisochromen-1-ylidene)azanium; tris(fluoranyl)methanesulfonate

Systemtic Name: dimethyl-(3-phenylisochromen-1-ylidene)azanium; tris(fluoranyl)methanesulfonate Openeye Name: dimethyl-(3-phenylisochromen-1-ylidene)ammonium; trifluoromethanesulfonate CAS Name: dimethyl-(3-phenyl-2-benzopyran-1-ylidene)ammonium; trifluoromethanesulfonate IUPAC Name: dimethyl-(3-phenylisochromen-1-ylidene)azanium; trifluoromethanesulfonate Traditional Name: dimethyl-(3-phenylisochromen-1-ylidene)ammonium triflate Formula: C18H16F3NO4S MolecularWeight: 399.38415

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C2=CC=CC=C2C=C(O1)C3=CC=CC=C3)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[N+](=C1C2=CC=CC=C2C=C(O1)C3=CC=CC=C3)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H16NO.CHF3O3S/c1-18(2)17-15-11-7-6-10-14(15)12-16(19-17)13-8-4-3-5-9-13;2-1(3,4)8(5,6)7/h3-12H,1-2H3;(H,5,6,7)/q+1;/p-1