2,3-dihydropyrrol-1-ylmethyl 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: 2,3-dihydropyrrol-1-ylmethyl 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: 2,3-dihydropyrrol-1-ylmethyl 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid 2,3-dihydropyrrol-1-ylmethyl ester IUPAC Name: 2,3-dihydropyrrol-1-ylmethyl 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid 2-pyrrolin-1-ylmethyl ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCN2CCC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCN2CCC=C2

InChI

InChI=1S/C20H29NO3/c1-19(2,3)15-11-14(12-16(17(15)22)20(4,5)6)18(23)24-13-21-9-7-8-10-21/h7,9,11-12,22H,8,10,13H2,1-6H3