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

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1-tert-butyl-pyrrolidin-2-one Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-tert-butyl-pyrrolidin-2-one CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1-tert-butyl-2-pyrrolidinone IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-tert-butylpyrrolidin-2-one Traditional Name: 1-tert-butyl-4-(4-piperonylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(CC1=O)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)N1CC(CC1=O)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H29N3O4/c1-21(2,3)24-13-16(11-19(24)25)20(26)23-8-6-22(7-9-23)12-15-4-5-17-18(10-15)28-14-27-17/h4-5,10,16H,6-9,11-14H2,1-3H3