6-(6-bromanyl-1,3-benzodioxol-5-yl)-5-nitro-piperidin-2-one

Systemtic Name: 6-(6-bromanyl-1,3-benzodioxol-5-yl)-5-nitro-piperidin-2-one Openeye Name: 6-(6-bromo-1,3-benzodioxol-5-yl)-5-nitro-piperidin-2-one CAS Name: 6-(6-bromo-1,3-benzodioxol-5-yl)-5-nitro-2-piperidinone IUPAC Name: 6-(6-bromo-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one Traditional Name: 6-(6-bromo-1,3-benzodioxol-5-yl)-5-nitro-2-piperidone Formula: C12H11BrN2O5 MolecularWeight: 343.13014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(C1[N+](=O)[O-])C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

C1CC(=O)NC(C1[N+](=O)[O-])C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C12H11BrN2O5/c13-7-4-10-9(19-5-20-10)3-6(7)12-8(15(17)18)1-2-11(16)14-12/h3-4,8,12H,1-2,5H2,(H,14,16)