2-[[4-(3-fluoranyl-4-methoxy-phenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-(3-fluoranyl-4-methoxy-phenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-(3-fluoro-4-methoxy-phenyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[4-(3-fluoro-4-methoxyphenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[4-(3-fluoro-4-methoxy-phenyl)-4-keto-butanoyl]amino]-3-phenyl-propionic acid Formula: C20H20FNO5 MolecularWeight: 373.374903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC(CC2=CC=CC=C2)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC(CC2=CC=CC=C2)C(=O)O)F

InChI

InChI=1S/C20H20FNO5/c1-27-18-9-7-14(12-15(18)21)17(23)8-10-19(24)22-16(20(25)26)11-13-5-3-2-4-6-13/h2-7,9,12,16H,8,10-11H2,1H3,(H,22,24)(H,25,26)