N-[2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(3,3-dimethylbutanoyl)piperazino]ethyl]-piperonylamide Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)CCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)CCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H29N3O4/c1-20(2,3)13-18(24)23-10-8-22(9-11-23)7-6-21-19(25)15-4-5-16-17(12-15)27-14-26-16/h4-5,12H,6-11,13-14H2,1-3H3,(H,21,25)