4-(4-isoquinolin-3-ylpiperazin-1-yl)-1-phenyl-butan-1-one

Systemtic Name: 4-(4-isoquinolin-3-ylpiperazin-1-yl)-1-phenyl-butan-1-one Openeye Name: 4-[4-(3-isoquinolyl)piperazin-1-yl]-1-phenyl-butan-1-one CAS Name: 4-[4-(3-isoquinolinyl)-1-piperazinyl]-1-phenyl-1-butanone IUPAC Name: 4-(4-isoquinolin-3-ylpiperazin-1-yl)-1-phenylbutan-1-one Traditional Name: 4-[4-(3-isoquinolyl)piperazino]-1-phenyl-butan-1-one Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=CC=C2)C3=CC4=CC=CC=C4C=N3

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=CC=C2)C3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C23H25N3O/c27-22(19-7-2-1-3-8-19)11-6-12-25-13-15-26(16-14-25)23-17-20-9-4-5-10-21(20)18-24-23/h1-5,7-10,17-18H,6,11-16H2