[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: [2-(4-isopropylanilino)-2-oxo-ethyl] (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid [2-oxo-2-(4-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylanilino)ethyl] (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid (2-cumidino-2-keto-ethyl) ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)COC(=O)C(C)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=C(C=C1)C(C)C)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O4/c1-14(2)16-9-11-18(12-10-16)23-19(25)13-28-20(26)15(3)22-21(27)24-17-7-5-4-6-8-17/h4-12,14-15H,13H2,1-3H3,(H,23,25)(H2,22,24,27)/t15-/m0/s1