[4-(1-chloranylisoquinolin-3-yl)piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-(1-chloranylisoquinolin-3-yl)piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-(1-chloro-3-isoquinolyl)piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [4-(1-chloro-3-isoquinolinyl)-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [4-(1-chloroisoquinolin-3-yl)piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-(1-chloro-3-isoquinolyl)piperazino]-(1-naphthyl)methanone Formula: C24H20ClN3O MolecularWeight: 401.8881

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=CC=CC=C3C(=N2)Cl)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC3=CC=CC=C3C(=N2)Cl)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H20ClN3O/c25-23-20-10-4-2-7-18(20)16-22(26-23)27-12-14-28(15-13-27)24(29)21-11-5-8-17-6-1-3-9-19(17)21/h1-11,16H,12-15H2