5-[2-(3-chlorophenyl)ethynyl]-2-piperidin-1-yl-pyrimidine

Systemtic Name: 5-[2-(3-chlorophenyl)ethynyl]-2-piperidin-1-yl-pyrimidine Openeye Name: 5-[2-(3-chlorophenyl)ethynyl]-2-(1-piperidyl)pyrimidine CAS Name: 5-[2-(3-chlorophenyl)ethynyl]-2-(1-piperidinyl)pyrimidine IUPAC Name: 5-[2-(3-chlorophenyl)ethynyl]-2-piperidin-1-ylpyrimidine Traditional Name: 5-[2-(3-chlorophenyl)ethynyl]-2-piperidino-pyrimidine Formula: C17H16ClN3 MolecularWeight: 297.78204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C=N2)C#CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C=N2)C#CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H16ClN3/c18-16-6-4-5-14(11-16)7-8-15-12-19-17(20-13-15)21-9-2-1-3-10-21/h4-6,11-13H,1-3,9-10H2