[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] (3S)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] (3S)-3-acetamido-3-phenyl-propanoate Openeye Name: [(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl] (3S)-3-acetamido-3-phenyl-propanoate CAS Name: (3S)-3-acetamido-3-phenylpropanoic acid [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] (3S)-3-acetamido-3-phenylpropanoate Traditional Name: (3S)-3-acetamido-3-phenyl-propionic acid [(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C[C@@H](C2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C22H25N3O5/c1-14(22(29)25-19-11-9-18(10-12-19)23-15(2)26)30-21(28)13-20(24-16(3)27)17-7-5-4-6-8-17/h4-12,14,20H,13H2,1-3H3,(H,23,26)(H,24,27)(H,25,29)/t14-,20+/m1/s1