3-piperidin-1-ylpropyl 4-fluoranyl-3-iodanyl-benzoate hydrochloride

Systemtic Name: 3-piperidin-1-ylpropyl 4-fluoranyl-3-iodanyl-benzoate hydrochloride Openeye Name: 3-(1-piperidyl)propyl 4-fluoro-3-iodo-benzoate hydrochloride CAS Name: 4-fluoro-3-iodobenzoic acid 3-(1-piperidinyl)propyl ester hydrochloride IUPAC Name: 3-piperidin-1-ylpropyl 4-fluoro-3-iodobenzoate hydrochloride Traditional Name: 4-fluoro-3-iodo-benzoic acid 3-piperidinopropyl ester hydrochloride Formula: C15H20ClFINO2 MolecularWeight: 427.680673

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC(=O)C2=CC(=C(C=C2)F)I.Cl

Isomeric SMILES

C1CCN(CC1)CCCOC(=O)C2=CC(=C(C=C2)F)I.Cl

InChI

InChI=1S/C15H19FINO2.ClH/c16-13-6-5-12(11-14(13)17)15(19)20-10-4-9-18-7-2-1-3-8-18;/h5-6,11H,1-4,7-10H2;1H