dodecyl 3-bromanyl-5-iodanyl-benzoate

Systemtic Name: dodecyl 3-bromanyl-5-iodanyl-benzoate Openeye Name: dodecyl 3-bromo-5-iodo-benzoate CAS Name: 3-bromo-5-iodobenzoic acid dodecyl ester IUPAC Name: dodecyl 3-bromo-5-iodobenzoate Traditional Name: 3-bromo-5-iodo-benzoic acid lauryl ester Formula: C19H28BrIO2 MolecularWeight: 495.23289

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)I)Br

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)I)Br

InChI

InChI=1S/C19H28BrIO2/c1-2-3-4-5-6-7-8-9-10-11-12-23-19(22)16-13-17(20)15-18(21)14-16/h13-15H,2-12H2,1H3