(3,7-ditert-butylcyclooctyl) 4-bromanylbenzoate

Systemtic Name: (3,7-ditert-butylcyclooctyl) 4-bromanylbenzoate Openeye Name: (3,7-ditert-butylcyclooctyl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid (3,7-ditert-butylcyclooctyl) ester IUPAC Name: (3,7-ditert-butylcyclooctyl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (3,7-ditert-butylcyclooctyl) ester Formula: C23H35BrO2 MolecularWeight: 423.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCCC(CC(C1)OC(=O)C2=CC=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1CCCC(CC(C1)OC(=O)C2=CC=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C23H35BrO2/c1-22(2,3)17-8-7-9-18(23(4,5)6)15-20(14-17)26-21(25)16-10-12-19(24)13-11-16/h10-13,17-18,20H,7-9,14-15H2,1-6H3