[(2R)-1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl] (2S)-2-(aminocarbonylamino)-3-phenyl-propanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl] (2S)-2-(aminocarbonylamino)-3-phenyl-propanoate Openeye Name: [(1R)-2-(2-isopropylanilino)-1-methyl-2-oxo-ethyl] (2S)-3-phenyl-2-ureido-propanoate CAS Name: (2S)-2-(carbamoylamino)-3-phenylpropanoic acid [(2R)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl] (2S)-2-(carbamoylamino)-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-ureido-propionic acid [(1R)-2-(2-isopropylanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C(CC2=CC=CC=C2)NC(=O)N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(C)C)OC(=O)[C@H](CC2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C22H27N3O4/c1-14(2)17-11-7-8-12-18(17)24-20(26)15(3)29-21(27)19(25-22(23)28)13-16-9-5-4-6-10-16/h4-12,14-15,19H,13H2,1-3H3,(H,24,26)(H3,23,25,28)/t15-,19+/m1/s1