2-diethylaminoethyl 4-fluoranyl-3-iodanyl-benzoate

Systemtic Name: 2-diethylaminoethyl 4-fluoranyl-3-iodanyl-benzoate Openeye Name: 2-diethylaminoethyl 4-fluoro-3-iodo-benzoate CAS Name: 4-fluoro-3-iodobenzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-fluoro-3-iodobenzoate Traditional Name: 4-fluoro-3-iodo-benzoic acid 2-diethylaminoethyl ester Formula: C13H17FINO2 MolecularWeight: 365.182453

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC(=C(C=C1)F)I

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC(=C(C=C1)F)I

InChI

InChI=1S/C13H17FINO2/c1-3-16(4-2)7-8-18-13(17)10-5-6-11(14)12(15)9-10/h5-6,9H,3-4,7-8H2,1-2H3