4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1-(3-chloranyl-4-fluoranyl-phenyl)pyrrolidin-2-one

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1-(3-chloranyl-4-fluoranyl-phenyl)pyrrolidin-2-one Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-(3-chloro-4-fluoro-phenyl)pyrrolidin-2-one CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1-(3-chloro-4-fluorophenyl)-2-pyrrolidinone IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-(3-chloro-4-fluorophenyl)pyrrolidin-2-one Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-4-(4-piperonylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C23H23ClFN3O4 MolecularWeight: 459.897823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4CC(=O)N(C4)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4CC(=O)N(C4)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C23H23ClFN3O4/c24-18-11-17(2-3-19(18)25)28-13-16(10-22(28)29)23(30)27-7-5-26(6-8-27)12-15-1-4-20-21(9-15)32-14-31-20/h1-4,9,11,16H,5-8,10,12-14H2