5-(4-chlorophenyl)-2-[4-[4-(pyrrolidin-1-ylmethyl)phenyl]but-1-ynyl]pyridine

Systemtic Name: 5-(4-chlorophenyl)-2-[4-[4-(pyrrolidin-1-ylmethyl)phenyl]but-1-ynyl]pyridine Openeye Name: 5-(4-chlorophenyl)-2-[4-[4-(pyrrolidin-1-ylmethyl)phenyl]but-1-ynyl]pyridine CAS Name: 5-(4-chlorophenyl)-2-[4-[4-(1-pyrrolidinylmethyl)phenyl]but-1-ynyl]pyridine IUPAC Name: 5-(4-chlorophenyl)-2-[4-[4-(pyrrolidin-1-ylmethyl)phenyl]but-1-ynyl]pyridine Traditional Name: 5-(4-chlorophenyl)-2-[4-[4-(pyrrolidinomethyl)phenyl]but-1-ynyl]pyridine Formula: C26H25ClN2 MolecularWeight: 400.9431

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CCC#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CCC#CC3=NC=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H25ClN2/c27-25-14-11-23(12-15-25)24-13-16-26(28-19-24)6-2-1-5-21-7-9-22(10-8-21)20-29-17-3-4-18-29/h7-16,19H,1,3-5,17-18,20H2