1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanone

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanone Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]ethanone CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-[4-(5-chloro-2-methyl-phenyl)piperazino]ethanone Formula: C24H26ClN3O2 MolecularWeight: 423.93514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C[C@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C24H26ClN3O2/c1-17-7-8-20(25)15-22(17)26-11-13-27(14-12-26)24(30)16-23-21-6-4-3-5-19(21)9-10-28(23)18(2)29/h3-10,15,23H,11-14,16H2,1-2H3/t23-/m0/s1