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

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1-(phenylmethyl)pyrrolidin-2-one Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-benzyl-pyrrolidin-2-one CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1-(phenylmethyl)-2-pyrrolidinone IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-benzylpyrrolidin-2-one Traditional Name: 1-benzyl-4-(4-piperonylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C24H27N3O4 MolecularWeight: 421.48888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4CC(=O)N(C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4CC(=O)N(C4)CC5=CC=CC=C5

InChI

InChI=1S/C24H27N3O4/c28-23-13-20(16-27(23)15-18-4-2-1-3-5-18)24(29)26-10-8-25(9-11-26)14-19-6-7-21-22(12-19)31-17-30-21/h1-7,12,20H,8-11,13-17H2