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

Systemtic Name: O1-ethyl O4-[(2R)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-(4-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-(4-fluoroanilino)-1-oxopropan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-(4-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C15H16FNO5 MolecularWeight: 309.289643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)F

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)F

InChI

InChI=1S/C15H16FNO5/c1-3-21-13(18)8-9-14(19)22-10(2)15(20)17-12-6-4-11(16)5-7-12/h4-10H,3H2,1-2H3,(H,17,20)/b9-8+/t10-/m1/s1