5-[[3-(2-fluorophenyl)propanoylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[3-(2-fluorophenyl)propanoylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[3-(2-fluorophenyl)propanoylamino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[3-(2-fluorophenyl)-1-oxopropyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[3-(2-fluorophenyl)propanoylamino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[3-(2-fluorophenyl)propanoylamino]methyl]-2-methoxy-benzoic acid Formula: C18H18FNO4 MolecularWeight: 331.338223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCC2=CC=CC=C2F)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCC2=CC=CC=C2F)C(=O)O

InChI

InChI=1S/C18H18FNO4/c1-24-16-8-6-12(10-14(16)18(22)23)11-20-17(21)9-7-13-4-2-3-5-15(13)19/h2-6,8,10H,7,9,11H2,1H3,(H,20,21)(H,22,23)