3-(2,4-dimethoxyphenyl)-4-nitro-cyclohexan-1-one

Systemtic Name: 3-(2,4-dimethoxyphenyl)-4-nitro-cyclohexan-1-one Openeye Name: 3-(2,4-dimethoxyphenyl)-4-nitro-cyclohexanone CAS Name: 3-(2,4-dimethoxyphenyl)-4-nitro-1-cyclohexanone IUPAC Name: 3-(2,4-dimethoxyphenyl)-4-nitrocyclohexan-1-one Traditional Name: 3-(2,4-dimethoxyphenyl)-4-nitro-cyclohexanone Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CC(=O)CCC2[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CC(=O)CCC2[N+](=O)[O-])OC

InChI

InChI=1S/C14H17NO5/c1-19-10-4-5-11(14(8-10)20-2)12-7-9(16)3-6-13(12)15(17)18/h4-5,8,12-13H,3,6-7H2,1-2H3