6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)quinoline

Systemtic Name: 6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)quinoline Openeye Name: 6-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-2-(pyrrolidin-1-ylmethyl)quinoline CAS Name: 6-[2-[5-(4-chlorophenyl)-2-pyridinyl]ethynyl]-2-(1-pyrrolidinylmethyl)quinoline IUPAC Name: 6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)quinoline Traditional Name: 6-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-2-(pyrrolidinomethyl)quinoline Formula: C27H22ClN3 MolecularWeight: 423.93668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=NC3=C(C=C2)C=C(C=C3)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C1)CC2=NC3=C(C=C2)C=C(C=C3)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H22ClN3/c28-24-9-5-21(6-10-24)23-8-12-25(29-18-23)11-3-20-4-14-27-22(17-20)7-13-26(30-27)19-31-15-1-2-16-31/h4-10,12-14,17-18H,1-2,15-16,19H2