O1-ethyl O4-[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 4-O-[(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C20H18FNO5 MolecularWeight: 371.359023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H18FNO5/c1-2-26-17(23)12-13-18(24)27-19(14-6-4-3-5-7-14)20(25)22-16-10-8-15(21)9-11-16/h3-13,19H,2H2,1H3,(H,22,25)/b13-12+/t19-/m1/s1