5-(1,3-benzodioxol-5-ylmethyl)-5-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrrolidin-2-one

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrrolidin-2-one Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrrolidin-2-one CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-2-pyrrolidinone IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrrolidin-2-one Traditional Name: 5-[3-keto-3-(4-phenylpiperazino)propyl]-5-piperonyl-2-pyrrolidone Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1=O)(CCC(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(NC1=O)(CCC(=O)N2CCN(CC2)C3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H29N3O4/c29-23-8-10-25(26-23,17-19-6-7-21-22(16-19)32-18-31-21)11-9-24(30)28-14-12-27(13-15-28)20-4-2-1-3-5-20/h1-7,16H,8-15,17-18H2,(H,26,29)