1-[2-(4-piperidin-1-ylphenyl)ethynyl]isoquinoline

Systemtic Name: 1-[2-(4-piperidin-1-ylphenyl)ethynyl]isoquinoline Openeye Name: 1-[2-[4-(1-piperidyl)phenyl]ethynyl]isoquinoline CAS Name: 1-[2-[4-(1-piperidinyl)phenyl]ethynyl]isoquinoline IUPAC Name: 1-[2-(4-piperidin-1-ylphenyl)ethynyl]isoquinoline Traditional Name: 1-[2-(4-piperidinophenyl)ethynyl]isoquinoline Formula: C22H20N2 MolecularWeight: 312.4076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C#CC3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C#CC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N2/c1-4-16-24(17-5-1)20-11-8-18(9-12-20)10-13-22-21-7-3-2-6-19(21)14-15-23-22/h2-3,6-9,11-12,14-15H,1,4-5,16-17H2