2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)pentan-1-one

Systemtic Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)pentan-1-one Openeye Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)pentan-1-one CAS Name: 2-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-pentanone IUPAC Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)pentan-1-one Traditional Name: 2-[4-(3,4-dichlorophenyl)piperazino]-1-(3,4-dihydro-1H-isoquinolin-2-yl)pentan-1-one Formula: C24H29Cl2N3O MolecularWeight: 446.41256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCC2=CC=CC=C2C1)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCCC(C(=O)N1CCC2=CC=CC=C2C1)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H29Cl2N3O/c1-2-5-23(24(30)29-11-10-18-6-3-4-7-19(18)17-29)28-14-12-27(13-15-28)20-8-9-21(25)22(26)16-20/h3-4,6-9,16,23H,2,5,10-15,17H2,1H3