tert-butyl [4-[6-cyano-2-(4-hydroxyphenyl)-2,4,6-trimethyl-octan-4-yl]phenyl] carbonate

Systemtic Name: tert-butyl [4-[6-cyano-2-(4-hydroxyphenyl)-2,4,6-trimethyl-octan-4-yl]phenyl] carbonate Openeye Name: tert-butyl [4-[3-cyano-1-[2-(4-hydroxyphenyl)-2-methyl-propyl]-1,3-dimethyl-pentyl]phenyl] carbonate CAS Name: carbonic acid tert-butyl [4-[6-cyano-2-(4-hydroxyphenyl)-2,4,6-trimethyloctan-4-yl]phenyl] ester IUPAC Name: tert-butyl [4-[6-cyano-2-(4-hydroxyphenyl)-2,4,6-trimethyloctan-4-yl]phenyl] carbonate Traditional Name: carbonic acid tert-butyl [4-[3-cyano-1-[2-(4-hydroxyphenyl)-2-methyl-propyl]-1,3-dimethyl-pentyl]phenyl] ester Formula: C29H39NO4 MolecularWeight: 465.62426

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(CC(C)(C)C1=CC=C(C=C1)O)C2=CC=C(C=C2)OC(=O)OC(C)(C)C)C#N

Isomeric SMILES

CCC(C)(CC(C)(CC(C)(C)C1=CC=C(C=C1)O)C2=CC=C(C=C2)OC(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C29H39NO4/c1-9-28(7,20-30)19-29(8,18-27(5,6)21-10-14-23(31)15-11-21)22-12-16-24(17-13-22)33-25(32)34-26(2,3)4/h10-17,31H,9,18-19H2,1-8H3