5-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-8-(2-pyrrolidin-1-ylethoxy)quinoline

Systemtic Name: 5-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-8-(2-pyrrolidin-1-ylethoxy)quinoline Openeye Name: 5-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-8-(2-pyrrolidin-1-ylethoxy)quinoline CAS Name: 5-[2-[5-(4-chlorophenyl)-2-pyridinyl]ethynyl]-8-[2-(1-pyrrolidinyl)ethoxy]quinoline IUPAC Name: 5-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-8-(2-pyrrolidin-1-ylethoxy)quinoline Traditional Name: 5-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-8-(2-pyrrolidinoethoxy)quinoline Formula: C28H24ClN3O MolecularWeight: 453.96266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C3C(=C(C=C2)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl)C=CC=N3

Isomeric SMILES

C1CCN(C1)CCOC2=C3C(=C(C=C2)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl)C=CC=N3

InChI

InChI=1S/C28H24ClN3O/c29-24-10-5-21(6-11-24)23-8-13-25(31-20-23)12-7-22-9-14-27(28-26(22)4-3-15-30-28)33-19-18-32-16-1-2-17-32/h3-6,8-11,13-15,20H,1-2,16-19H2