[(2S)-1-oxidanylidene-1-[[(2S)-2-phenylpropyl]amino]propan-2-yl] 2-(phenylcarbonyl)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[(2S)-2-phenylpropyl]amino]propan-2-yl] 2-(phenylcarbonyl)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-benzoylbenzoate CAS Name: 2-benzoylbenzoic acid [(2S)-1-oxo-1-[[(2S)-2-phenylpropyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[[(2S)-2-phenylpropyl]amino]propan-2-yl] 2-benzoylbenzoate Traditional Name: 2-benzoylbenzoic acid [(1S)-2-keto-1-methyl-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C26H25NO4 MolecularWeight: 415.481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)OC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)[C@H](C)OC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H25NO4/c1-18(20-11-5-3-6-12-20)17-27-25(29)19(2)31-26(30)23-16-10-9-15-22(23)24(28)21-13-7-4-8-14-21/h3-16,18-19H,17H2,1-2H3,(H,27,29)/t18-,19+/m1/s1