4-[2-(4-methoxyphenyl)ethynyl]isoquinoline

Systemtic Name: 4-[2-(4-methoxyphenyl)ethynyl]isoquinoline Openeye Name: 4-[2-(4-methoxyphenyl)ethynyl]isoquinoline CAS Name: 4-[2-(4-methoxyphenyl)ethynyl]isoquinoline IUPAC Name: 4-[2-(4-methoxyphenyl)ethynyl]isoquinoline Traditional Name: 4-[2-(4-methoxyphenyl)ethynyl]isoquinoline Formula: C18H13NO MolecularWeight: 259.30192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=CN=CC3=CC=CC=C32

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=CN=CC3=CC=CC=C32

InChI

InChI=1S/C18H13NO/c1-20-17-10-7-14(8-11-17)6-9-16-13-19-12-15-4-2-3-5-18(15)16/h2-5,7-8,10-13H,1H3