3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxidanylidenepiperidin-1-yl)piperidin-1-yl]propyl]-2-ethyl-3H-isoindol-1-one hydrochloride

Systemtic Name: 3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxidanylidenepiperidin-1-yl)piperidin-1-yl]propyl]-2-ethyl-3H-isoindol-1-one hydrochloride Openeye Name: 3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxo-1-piperidyl)-1-piperidyl]propyl]-2-ethyl-isoindolin-1-one hydrochloride CAS Name: 3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxo-1-piperidinyl)-1-piperidinyl]propyl]-2-ethyl-3H-isoindol-1-one hydrochloride IUPAC Name: 3-[1-(3,4-dichlorophenyl)-3-[4-(2-oxopiperidin-1-yl)piperidin-1-yl]propyl]-2-ethyl-3H-isoindol-1-one hydrochloride Traditional Name: 3-[1-(3,4-dichlorophenyl)-3-[4-(2-ketopiperidino)piperidino]propyl]-2-ethyl-isoindolin-1-one hydrochloride Formula: C29H36Cl3N3O2 MolecularWeight: 564.97404

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C2=CC=CC=C2C1=O)C(CCN3CCC(CC3)N4CCCCC4=O)C5=CC(=C(C=C5)Cl)Cl.Cl

Isomeric SMILES

CCN1C(C2=CC=CC=C2C1=O)C(CCN3CCC(CC3)N4CCCCC4=O)C5=CC(=C(C=C5)Cl)Cl.Cl

InChI

InChI=1S/C29H35Cl2N3O2.ClH/c1-2-33-28(23-7-3-4-8-24(23)29(33)36)22(20-10-11-25(30)26(31)19-20)14-18-32-16-12-21(13-17-32)34-15-6-5-9-27(34)35;/h3-4,7-8,10-11,19,21-22,28H,2,5-6,9,12-18H2,1H3;1H