4-[[3-chloranyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[3-chloranyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylamino]-4-oxobutanoate Traditional Name: 4-[[3-chloro-4-(4-fluorobenzyl)oxy-5-methoxy-benzyl]amino]-4-keto-butyrate Formula: C19H18ClFNO5- MolecularWeight: 394.801323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC(=O)CCC(=O)[O-])Cl)OCC2=CC=C(C=C2)F

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC(=O)CCC(=O)[O-])Cl)OCC2=CC=C(C=C2)F

InChI

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