5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazinylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazinylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazono]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazinylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazinylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)hydrazono]cyclohexane-1,3-quinone Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=NNC2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=NNC2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C(=O)C1)C

InChI

InChI=1S/C16H17N3O6/c1-16(2)7-11(20)15(12(21)8-16)18-17-9-5-13-14(25-4-3-24-13)6-10(9)19(22)23/h5-6,17H,3-4,7-8H2,1-2H3