tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] carbonate

Systemtic Name: tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] carbonate Openeye Name: tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] carbonate CAS Name: carbonic acid tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] ester IUPAC Name: tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] carbonate Traditional Name: carbonic acid tert-butyl [2,6-ditert-butyl-4-(3-nitrooxypropyl)phenyl] ester Formula: C22H35NO6 MolecularWeight: 409.5164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC(=O)OC(C)(C)C)C(C)(C)C)CCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC(=O)OC(C)(C)C)C(C)(C)C)CCCO[N+](=O)[O-]

InChI

InChI=1S/C22H35NO6/c1-20(2,3)16-13-15(11-10-12-27-23(25)26)14-17(21(4,5)6)18(16)28-19(24)29-22(7,8)9/h13-14H,10-12H2,1-9H3