2-[1-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-ium-1-yl]ethyl ethanoate

Systemtic Name: 2-[1-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-ium-1-yl]ethyl ethanoate Openeye Name: 2-[1-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-ium-1-yl]ethyl acetate CAS Name: acetic acid 2-[1-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidin-1-iumyl]ethyl ester IUPAC Name: 2-[1-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-ium-1-yl]ethyl acetate Traditional Name: acetic acid 2-[1-(6-fluoroindoxazen-3-yl)piperidin-1-ium-1-yl]ethyl ester Formula: C16H20FN2O3+ MolecularWeight: 307.340003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[N+]1(CCCCC1)C2=NOC3=C2C=CC(=C3)F

Isomeric SMILES

CC(=O)OCC[N+]1(CCCCC1)C2=NOC3=C2C=CC(=C3)F

InChI

InChI=1S/C16H20FN2O3/c1-12(20)21-10-9-19(7-3-2-4-8-19)16-14-6-5-13(17)11-15(14)22-18-16/h5-6,11H,2-4,7-10H2,1H3/q+1