[3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propyl] 2-fluoranylbenzoate

Systemtic Name: [3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propyl] 2-fluoranylbenzoate Openeye Name: [3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propyl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propyl] ester IUPAC Name: [2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propyl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propyl] ester Formula: C15H18FNO3 MolecularWeight: 279.306723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NCC(COC(=O)C1=CC=CC=C1F)O

Isomeric SMILES

CC(C)(C#C)NCC(COC(=O)C1=CC=CC=C1F)O

InChI

InChI=1S/C15H18FNO3/c1-4-15(2,3)17-9-11(18)10-20-14(19)12-7-5-6-8-13(12)16/h1,5-8,11,17-18H,9-10H2,2-3H3