O4-[(1R)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[(1R)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[(1R)-2-(3-acetylanilino)-2-oxo-1-phenyl-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[(1R)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] ester O1-ethyl ester IUPAC Name: 4-O-[(1R)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(1R)-2-(3-acetylanilino)-2-keto-1-phenyl-ethyl] ester O1-ethyl ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO6/c1-3-28-19(25)12-13-20(26)29-21(16-8-5-4-6-9-16)22(27)23-18-11-7-10-17(14-18)15(2)24/h4-14,21H,3H2,1-2H3,(H,23,27)/b13-12+/t21-/m1/s1