2-cyanoethyl 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: 2-cyanoethyl 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: 2-cyanoethyl 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid 2-cyanoethyl ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCCC#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCCC#N

InChI

InChI=1S/C18H25NO3/c1-17(2,3)13-10-12(16(21)22-9-7-8-19)11-14(15(13)20)18(4,5)6/h10-11,20H,7,9H2,1-6H3