4-[[3-chloranyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-chloranyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-chloro-4-(2-fluorobenzyl)oxy-5-methoxy-benzyl]amino]-4-keto-butyric acid Formula: C19H19ClFNO5 MolecularWeight: 395.809263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC(=O)CCC(=O)O)Cl)OCC2=CC=CC=C2F

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC(=O)CCC(=O)O)Cl)OCC2=CC=CC=C2F

InChI

InChI=1S/C19H19ClFNO5/c1-26-16-9-12(10-22-17(23)6-7-18(24)25)8-14(20)19(16)27-11-13-4-2-3-5-15(13)21/h2-5,8-9H,6-7,10-11H2,1H3,(H,22,23)(H,24,25)