[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] (3S)-3-phenylbutanoate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] (3S)-3-phenylbutanoate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] (3S)-3-phenylbutanoate CAS Name: (3S)-3-phenylbutanoic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] (3S)-3-phenylbutanoate Traditional Name: (3S)-3-phenylbutyric acid (2-keto-2-mesidino-ethyl) ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)CC(C)C2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C[C@H](C)C2=CC=CC=C2)C

InChI

InChI=1S/C21H25NO3/c1-14-10-16(3)21(17(4)11-14)22-19(23)13-25-20(24)12-15(2)18-8-6-5-7-9-18/h5-11,15H,12-13H2,1-4H3,(H,22,23)/t15-/m0/s1