3-phenyl-4-(2-phenylethynyl)isoquinoline

Systemtic Name: 3-phenyl-4-(2-phenylethynyl)isoquinoline Openeye Name: 3-phenyl-4-(2-phenylethynyl)isoquinoline CAS Name: 3-phenyl-4-(2-phenylethynyl)isoquinoline IUPAC Name: 3-phenyl-4-(2-phenylethynyl)isoquinoline Traditional Name: 3-phenyl-4-(2-phenylethynyl)isoquinoline Formula: C23H15N MolecularWeight: 305.3719

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(N=CC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(N=CC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H15N/c1-3-9-18(10-4-1)15-16-22-21-14-8-7-13-20(21)17-24-23(22)19-11-5-2-6-12-19/h1-14,17H