tert-butyl (E)-8-nitro-7-oxidanyl-oct-2-enoate

Systemtic Name: tert-butyl (E)-8-nitro-7-oxidanyl-oct-2-enoate Openeye Name: tert-butyl (E)-7-hydroxy-8-nitro-oct-2-enoate CAS Name: (E)-7-hydroxy-8-nitro-2-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-7-hydroxy-8-nitrooct-2-enoate Traditional Name: (E)-7-hydroxy-8-nitro-oct-2-enoic acid tert-butyl ester Formula: C12H21NO5 MolecularWeight: 259.29884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CCCCC(C[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/CCCC(C[N+](=O)[O-])O

InChI

InChI=1S/C12H21NO5/c1-12(2,3)18-11(15)8-6-4-5-7-10(14)9-13(16)17/h6,8,10,14H,4-5,7,9H2,1-3H3/b8-6+