2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium

Systemtic Name: 2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium Openeye Name: 2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium CAS Name: 2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium IUPAC Name: 2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium Traditional Name: 2-methyl-6-(2-phenylethynyl)isoquinolin-2-ium Formula: C18H14N+ MolecularWeight: 244.31046

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=C(C=C1)C=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

C[N+]1=CC2=C(C=C1)C=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C18H14N/c1-19-12-11-17-13-16(9-10-18(17)14-19)8-7-15-5-3-2-4-6-15/h2-6,9-14H,1H3/q+1