tert-butyl [2-(5-isocyanobenzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenyl] carbonate

Systemtic Name: tert-butyl [2-(5-isocyanobenzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenyl] carbonate Openeye Name: tert-butyl [2-(5-isocyanobenzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-(5-isocyano-2-benzotriazolyl)-4-(2,4,4-trimethylpentan-2-yl)phenyl] ester IUPAC Name: tert-butyl [2-(5-isocyanobenzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-(5-isocyanobenzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenyl] ester Formula: C26H32N4O3 MolecularWeight: 448.55728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)OC(=O)OC(C)(C)C)N2N=C3C=CC(=CC3=N2)[N+]#[C-]

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)OC(=O)OC(C)(C)C)N2N=C3C=CC(=CC3=N2)[N+]#[C-]

InChI

InChI=1S/C26H32N4O3/c1-24(2,3)16-26(7,8)17-10-13-22(32-23(31)33-25(4,5)6)21(14-17)30-28-19-12-11-18(27-9)15-20(19)29-30/h10-15H,16H2,1-8H3