(3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitro-cyclohexan-1-one

Systemtic Name: (3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitro-cyclohexan-1-one Openeye Name: (3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitro-cyclohexanone CAS Name: (3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitro-1-cyclohexanone IUPAC Name: (3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitrocyclohexan-1-one Traditional Name: (3R,4S,5S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methoxy-4-nitro-cyclohexanone Formula: C12H19NO6 MolecularWeight: 273.28236

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2CC(=O)CC(C2[N+](=O)[O-])OC)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@@H]2CC(=O)C[C@@H]([C@H]2[N+](=O)[O-])OC)C

InChI

InChI=1S/C12H19NO6/c1-12(2)18-6-10(19-12)8-4-7(14)5-9(17-3)11(8)13(15)16/h8-11H,4-6H2,1-3H3/t8-,9-,10+,11-/m0/s1