(2S)-4-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: (2S)-4-(4,5-dimethoxy-2-methoxycarbonyl-anilino)-2-(4-fluorophenyl)-4-oxo-butanoate CAS Name: (2S)-4-(4,5-dimethoxy-2-methoxycarbonylanilino)-2-(4-fluorophenyl)-4-oxobutanoate IUPAC Name: (2S)-4-(4,5-dimethoxy-2-methoxycarbonylanilino)-2-(4-fluorophenyl)-4-oxobutanoate Traditional Name: (2S)-4-(2-carbomethoxy-4,5-dimethoxy-anilino)-2-(4-fluorophenyl)-4-keto-butyrate Formula: C20H19FNO7- MolecularWeight: 404.365763

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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)C[C@@H](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)/p-1/t13-/m0/s1