[2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate Openeye Name: [2-amino-1-(4-fluorophenyl)-2-oxo-ethyl] 4-(5-bromo-2-methoxy-phenyl)-4-oxo-butanoate CAS Name: 4-(5-bromo-2-methoxyphenyl)-4-oxobutanoic acid [2-amino-1-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-amino-1-(4-fluorophenyl)-2-oxoethyl] 4-(5-bromo-2-methoxyphenyl)-4-oxobutanoate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-4-keto-butyric acid [2-amino-1-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C19H17BrFNO5 MolecularWeight: 438.244383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OC(C2=CC=C(C=C2)F)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OC(C2=CC=C(C=C2)F)C(=O)N

InChI

InChI=1S/C19H17BrFNO5/c1-26-16-8-4-12(20)10-14(16)15(23)7-9-17(24)27-18(19(22)25)11-2-5-13(21)6-3-11/h2-6,8,10,18H,7,9H2,1H3,(H2,22,25)