[4-(2-phenylethynyl)phenyl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-phenylethynyl)phenyl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: [4-(2-phenylethynyl)phenyl]-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [4-(2-phenylethynyl)phenyl]-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-phenylethynyl)phenyl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(2-phenylethynyl)phenyl]-[4-(4-pyridylmethyl)piperazino]methanone Formula: C25H23N3O MolecularWeight: 381.46962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O/c29-25(28-18-16-27(17-19-28)20-23-12-14-26-15-13-23)24-10-8-22(9-11-24)7-6-21-4-2-1-3-5-21/h1-5,8-15H,16-20H2