[(1R)-1-cyanoethyl] 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: [(1R)-1-cyanoethyl] 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid [(1R)-1-cyanoethyl] ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C18H25NO3/c1-11(10-19)22-16(21)12-8-13(17(2,3)4)15(20)14(9-12)18(5,6)7/h8-9,11,20H,1-7H3/t11-/m1/s1