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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

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