2,6-ditert-butyl-1,3-dinitro-4-phenyl-cyclohexa-2,5-dien-1-ol

Systemtic Name: 2,6-ditert-butyl-1,3-dinitro-4-phenyl-cyclohexa-2,5-dien-1-ol Openeye Name: 2,6-ditert-butyl-1,3-dinitro-4-phenyl-cyclohexa-2,5-dien-1-ol CAS Name: 2,6-ditert-butyl-1,3-dinitro-4-phenyl-1-cyclohexa-2,5-dienol IUPAC Name: 2,6-ditert-butyl-1,3-dinitro-4-phenylcyclohexa-2,5-dien-1-ol Traditional Name: 2,6-ditert-butyl-1,3-dinitro-4-phenyl-cyclohexa-2,5-dien-1-ol Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(C(=C(C1([N+](=O)[O-])O)C(C)(C)C)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(C(=C(C1([N+](=O)[O-])O)C(C)(C)C)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C20H26N2O5/c1-18(2,3)15-12-14(13-10-8-7-9-11-13)16(21(24)25)17(19(4,5)6)20(15,23)22(26)27/h7-12,14,23H,1-6H3