3-chloranyl-2-iodanyl-benzoate; tetrabutylazanium

Systemtic Name: 3-chloranyl-2-iodanyl-benzoate; tetrabutylazanium Openeye Name: 3-chloro-2-iodo-benzoate; tetrabutylammonium CAS Name: 3-chloro-2-iodobenzoate; tetrabutylammonium IUPAC Name: 3-chloro-2-iodobenzoate; tetrabutylazanium Traditional Name: 3-chloro-2-iodo-benzoate; tetrabutylammonium Formula: C23H39ClINO2 MolecularWeight: 523.91873

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C(=C1)Cl)I)C(=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C(=C1)Cl)I)C(=O)[O-]

InChI

InChI=1S/C16H36N.C7H4ClIO2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;8-5-3-1-2-4(6(5)9)7(10)11/h5-16H2,1-4H3;1-3H,(H,10,11)/q+1;/p-1