(2R)-2-[(E,3R)-2-methyl-1-nitro-3-oxidanyl-pent-1-en-3-yl]cyclohexan-1-one

Systemtic Name: (2R)-2-[(E,3R)-2-methyl-1-nitro-3-oxidanyl-pent-1-en-3-yl]cyclohexan-1-one Openeye Name: (2R)-2-[(E,1R)-1-ethyl-1-hydroxy-2-methyl-3-nitro-allyl]cyclohexanone CAS Name: (2R)-2-[(E,3R)-3-hydroxy-2-methyl-1-nitropent-1-en-3-yl]-1-cyclohexanone IUPAC Name: (2R)-2-[(E,3R)-3-hydroxy-2-methyl-1-nitropent-1-en-3-yl]cyclohexan-1-one Traditional Name: (2R)-2-[(E,1R)-1-ethyl-1-hydroxy-2-methyl-3-nitro-allyl]cyclohexanone Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCCC1=O)(C(=C[N+](=O)[O-])C)O

Isomeric SMILES

CC[C@@]([C@H]1CCCCC1=O)(/C(=C/[N+](=O)[O-])/C)O

InChI

InChI=1S/C12H19NO4/c1-3-12(15,9(2)8-13(16)17)10-6-4-5-7-11(10)14/h8,10,15H,3-7H2,1-2H3/b9-8+/t10-,12-/m0/s1