5,5-dimethyl-2-nitro-3-(3-oxidanylpropylimino)cyclohexen-1-olate

Systemtic Name: 5,5-dimethyl-2-nitro-3-(3-oxidanylpropylimino)cyclohexen-1-olate Openeye Name: 3-(3-hydroxypropylimino)-5,5-dimethyl-2-nitro-cyclohexen-1-olate CAS Name: 3-(3-hydroxypropylimino)-5,5-dimethyl-2-nitro-1-cyclohexenolate IUPAC Name: 3-(3-hydroxypropylimino)-5,5-dimethyl-2-nitrocyclohexen-1-olate Traditional Name: 3-(3-hydroxypropylimino)-5,5-dimethyl-2-nitro-cyclohexen-1-olate Formula: C11H17N2O4- MolecularWeight: 241.26368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=NCCCO)C1)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1(CC(=C(C(=NCCCO)C1)[N+](=O)[O-])[O-])C

InChI

InChI=1S/C11H18N2O4/c1-11(2)6-8(12-4-3-5-14)10(13(16)17)9(15)7-11/h14-15H,3-7H2,1-2H3/p-1