1-[2-(4-methylphenyl)ethynyl]isoquinoline

Systemtic Name: 1-[2-(4-methylphenyl)ethynyl]isoquinoline Openeye Name: 1-[2-(p-tolyl)ethynyl]isoquinoline CAS Name: 1-[2-(4-methylphenyl)ethynyl]isoquinoline IUPAC Name: 1-[2-(4-methylphenyl)ethynyl]isoquinoline Traditional Name: 1-[2-(p-tolyl)ethynyl]isoquinoline Formula: C18H13N MolecularWeight: 243.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=NC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C18H13N/c1-14-6-8-15(9-7-14)10-11-18-17-5-3-2-4-16(17)12-13-19-18/h2-9,12-13H,1H3