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

Systemtic Name: O1-ethyl O4-[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] (E)-but-2-enedioate Openeye Name: O4-[(1R)-2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(1R)-2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester O1-ethyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H23NO6/c1-3-27-20(24)13-14-21(25)29-16(2)22(26)23-18-9-11-19(12-10-18)28-15-17-7-5-4-6-8-17/h4-14,16H,3,15H2,1-2H3,(H,23,26)/b14-13+/t16-/m1/s1