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

Systemtic Name: O1-ethyl O4-[(1R)-2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-2-(4-methylanilino)-2-oxo-1-phenyl-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(1R)-2-(4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 4-O-[(1R)-2-(4-methylanilino)-2-oxo-1-phenylethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-keto-1-phenyl-2-(p-toluidino)ethyl] ester Formula: C21H21NO5 MolecularWeight: 367.39514

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO5/c1-3-26-18(23)13-14-19(24)27-20(16-7-5-4-6-8-16)21(25)22-17-11-9-15(2)10-12-17/h4-14,20H,3H2,1-2H3,(H,22,25)/b14-13+/t20-/m1/s1