methyl 2-fluoranyl-5-[3-(2-phenylethanoylamino)propanoylamino]benzoate

Systemtic Name: methyl 2-fluoranyl-5-[3-(2-phenylethanoylamino)propanoylamino]benzoate Openeye Name: methyl 2-fluoro-5-[3-[(2-phenylacetyl)amino]propanoylamino]benzoate CAS Name: 2-fluoro-5-[[1-oxo-3-[(1-oxo-2-phenylethyl)amino]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-5-[3-[(2-phenylacetyl)amino]propanoylamino]benzoate Traditional Name: 2-fluoro-5-[3-[(2-phenylacetyl)amino]propanoylamino]benzoic acid methyl ester Formula: C19H19FN2O4 MolecularWeight: 358.363563

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CCNC(=O)CC2=CC=CC=C2)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CCNC(=O)CC2=CC=CC=C2)F

InChI

InChI=1S/C19H19FN2O4/c1-26-19(25)15-12-14(7-8-16(15)20)22-17(23)9-10-21-18(24)11-13-5-3-2-4-6-13/h2-8,12H,9-11H2,1H3,(H,21,24)(H,22,23)