5,5-dimethyl-2-nitro-cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-2-nitro-cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-2-nitro-cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-2-nitro-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-2-nitrocyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-2-nitro-cyclohex-2-en-1-one Formula: C8H11NO3 MolecularWeight: 169.17784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO3/c1-8(2)4-3-6(9(11)12)7(10)5-8/h3H,4-5H2,1-2H3