[1-(2-chlorophenyl)isoquinolin-3-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-(2-chlorophenyl)isoquinolin-3-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(2-chlorophenyl)-3-isoquinolyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(2-chlorophenyl)-3-isoquinolinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(2-chlorophenyl)isoquinolin-3-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(2-chlorophenyl)-3-isoquinolyl]-(4-methylpiperazino)methanone Formula: C21H20ClN3O MolecularWeight: 365.856

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C(=N2)C4=CC=CC=C4Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C(=N2)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H20ClN3O/c1-24-10-12-25(13-11-24)21(26)19-14-15-6-2-3-7-16(15)20(23-19)17-8-4-5-9-18(17)22/h2-9,14H,10-13H2,1H3