tert-butyl 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylate

Systemtic Name: tert-butyl 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylate Openeye Name: tert-butyl 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylate CAS Name: 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylate Traditional Name: 1,6,7-tritert-butyl-3,4-diazabicyclo[3.2.0]hepta-3,6-diene-5-carboxylic acid tert-butyl ester Formula: C22H38N2O2 MolecularWeight: 362.54932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C2(C1(CN=N2)C(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=C(C2(C1(CN=N2)C(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)C

InChI

InChI=1S/C22H38N2O2/c1-17(2,3)14-15(18(4,5)6)22(16(25)26-20(10,11)12)21(14,13-23-24-22)19(7,8)9/h13H2,1-12H3