1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H26ClN3O2/c24-20-6-3-7-21(16-20)25-12-14-26(15-13-25)22(28)8-9-23(29)27-11-10-18-4-1-2-5-19(18)17-27/h1-7,16H,8-15,17H2