N-(2-methylpropyl)-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methylpropyl)-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-isobutyl-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]acetamide CAS Name: N-(2-methylpropyl)-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-methylpropyl)-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-isobutyl-2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazino]acetamide Formula: C19H28N4O5 MolecularWeight: 392.44942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN1CCN(CC1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC(C)CNC(=O)CN1CCN(CC1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C19H28N4O5/c1-14(2)9-20-18(24)11-22-5-3-21(4-6-22)10-15-7-17(23(25)26)8-16-12-27-13-28-19(15)16/h7-8,14H,3-6,9-13H2,1-2H3,(H,20,24)