(2R)-4-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylammonio]-4-oxo-butanoate CAS Name: (2R)-4-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylammonio]-4-oxobutanoate IUPAC Name: (2R)-4-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylazaniumyl]-4-oxobutanoate Traditional Name: (2R)-4-(4-fluorophenyl)-4-keto-2-(p-anisylammonio)butyrate Formula: C18H18FNO4 MolecularWeight: 331.338223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]C(CC(=O)C2=CC=C(C=C2)F)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+][C@H](CC(=O)C2=CC=C(C=C2)F)C(=O)[O-]

InChI

InChI=1S/C18H18FNO4/c1-24-15-8-2-12(3-9-15)11-20-16(18(22)23)10-17(21)13-4-6-14(19)7-5-13/h2-9,16,20H,10-11H2,1H3,(H,22,23)/t16-/m1/s1