N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-isovalerylpiperazino)acetamide Formula: C19H26N4O5 MolecularWeight: 390.43354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H26N4O5/c1-13(2)9-18(25)23-7-5-22(6-8-23)11-17(24)21-19(26)20-14-3-4-15-16(10-14)28-12-27-15/h3-4,10,13H,5-9,11-12H2,1-2H3,(H2,20,21,24,26)