2-[2-[3-bromanyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]-5-(4-chlorophenyl)pyridine

Systemtic Name: 2-[2-[3-bromanyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]-5-(4-chlorophenyl)pyridine Openeye Name: 2-[2-[3-bromo-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]-5-(4-chlorophenyl)pyridine CAS Name: 2-[2-[3-bromo-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]ethynyl]-5-(4-chlorophenyl)pyridine IUPAC Name: 2-[2-[3-bromo-4-(2-pyrrolidin-1-ylethoxy)phenyl]ethynyl]-5-(4-chlorophenyl)pyridine Traditional Name: 2-[2-[3-bromo-4-(2-pyrrolidinoethoxy)phenyl]ethynyl]-5-(4-chlorophenyl)pyridine Formula: C25H22BrClN2O MolecularWeight: 481.81198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C(C=C(C=C2)C#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl)Br

Isomeric SMILES

C1CCN(C1)CCOC2=C(C=C(C=C2)C#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl)Br

InChI

InChI=1S/C25H22BrClN2O/c26-24-17-19(4-12-25(24)30-16-15-29-13-1-2-14-29)3-10-23-11-7-21(18-28-23)20-5-8-22(27)9-6-20/h4-9,11-12,17-18H,1-2,13-16H2