4-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4,5-dimethoxy-2-methoxycarbonyl-anilino)-2-(4-fluorophenyl)-4-oxo-butanoic acid CAS Name: 4-(4,5-dimethoxy-2-methoxycarbonylanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid IUPAC Name: 4-(4,5-dimethoxy-2-methoxycarbonylanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid Traditional Name: 4-(2-carbomethoxy-4,5-dimethoxy-anilino)-2-(4-fluorophenyl)-4-keto-butyric acid Formula: C20H20FNO7 MolecularWeight: 405.373703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CC(C2=CC=C(C=C2)F)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CC(C2=CC=C(C=C2)F)C(=O)O)OC

InChI

InChI=1S/C20H20FNO7/c1-27-16-8-14(20(26)29-3)15(10-17(16)28-2)22-18(23)9-13(19(24)25)11-4-6-12(21)7-5-11/h4-8,10,13H,9H2,1-3H3,(H,22,23)(H,24,25)