3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-piperidin-1-yl-1-pyrrolidin-1-yl-pentan-3-one; trihydrochloride

Systemtic Name: 3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-piperidin-1-yl-1-pyrrolidin-1-yl-pentan-3-one; trihydrochloride Openeye Name: 3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-(1-piperidyl)-1-pyrrolidin-1-yl-pentan-3-one; trihydrochloride CAS Name: 3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-(1-piperidinyl)-1-(1-pyrrolidinyl)-3-pentanone; trihydrochloride IUPAC Name: 3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-piperidin-1-yl-1-pyrrolidin-1-ylpentan-3-one; trihydrochloride Traditional Name: 3-azabicyclo[2.2.0]hexa-1,3,5-triene; 5-(4-chlorophenyl)-2-piperidino-1-pyrrolidino-pentan-3-one; trihydrochloride Formula: C25H35Cl4N3O MolecularWeight: 535.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CN2CCCC2)C(=O)CCC3=CC=C(C=C3)Cl.C1=CC2=NC=C21.Cl.Cl.Cl

Isomeric SMILES

C1CCN(CC1)C(CN2CCCC2)C(=O)CCC3=CC=C(C=C3)Cl.C1=CC2=NC=C21.Cl.Cl.Cl

InChI

InChI=1S/C20H29ClN2O.C5H3N.3ClH/c21-18-9-6-17(7-10-18)8-11-20(24)19(16-22-12-4-5-13-22)23-14-2-1-3-15-23;1-2-5-4(1)3-6-5;;;/h6-7,9-10,19H,1-5,8,11-16H2;1-3H;3*1H