[2-oxidanyl-3-[2-(2-phenylethanoylamino)ethylamino]propyl] 2-fluoranylbenzoate

Systemtic Name: [2-oxidanyl-3-[2-(2-phenylethanoylamino)ethylamino]propyl] 2-fluoranylbenzoate Openeye Name: [2-hydroxy-3-[2-[(2-phenylacetyl)amino]ethylamino]propyl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [2-hydroxy-3-[2-[(1-oxo-2-phenylethyl)amino]ethylamino]propyl] ester IUPAC Name: [2-hydroxy-3-[2-[(2-phenylacetyl)amino]ethylamino]propyl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [2-hydroxy-3-[2-[(2-phenylacetyl)amino]ethylamino]propyl] ester Formula: C20H23FN2O4 MolecularWeight: 374.406023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NCCNCC(COC(=O)C2=CC=CC=C2F)O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NCCNCC(COC(=O)C2=CC=CC=C2F)O

InChI

InChI=1S/C20H23FN2O4/c21-18-9-5-4-8-17(18)20(26)27-14-16(24)13-22-10-11-23-19(25)12-15-6-2-1-3-7-15/h1-9,16,22,24H,10-14H2,(H,23,25)