tert-butyl 2,4-dihexyl-6-iodanyl-benzoate

Systemtic Name: tert-butyl 2,4-dihexyl-6-iodanyl-benzoate Openeye Name: tert-butyl 2,4-dihexyl-6-iodo-benzoate CAS Name: 2,4-dihexyl-6-iodobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2,4-dihexyl-6-iodobenzoate Traditional Name: 2,4-dihexyl-6-iodo-benzoic acid tert-butyl ester Formula: C23H37IO2 MolecularWeight: 472.44315

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C(=C1)I)C(=O)OC(C)(C)C)CCCCCC

Isomeric SMILES

CCCCCCC1=CC(=C(C(=C1)I)C(=O)OC(C)(C)C)CCCCCC

InChI

InChI=1S/C23H37IO2/c1-6-8-10-12-14-18-16-19(15-13-11-9-7-2)21(20(24)17-18)22(25)26-23(3,4)5/h16-17H,6-15H2,1-5H3