[(2S)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate

Systemtic Name: [(2S)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate Openeye Name: [(1S)-1-methyl-2-[4-(2-methylpropanoylamino)phenyl]-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [(2S)-1-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[4-(2-methylpropanoylamino)phenyl]-1-oxopropan-2-yl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [(1S)-2-[4-(isobutyrylamino)phenyl]-2-keto-1-methyl-ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)C(C)OC(=O)C(C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O5/c1-14(2)21(27)25-19-12-10-17(11-13-19)20(26)16(4)30-23(29)15(3)24-22(28)18-8-6-5-7-9-18/h5-16H,1-4H3,(H,24,28)(H,25,27)/t15-,16-/m0/s1