[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] (2S)-2-(phenylcarbamoylamino)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-15(2)24(18-12-8-5-9-13-18)19(25)14-28-20(26)16(3)22-21(27)23-17-10-6-4-7-11-17/h4-13,15-16H,14H2,1-3H3,(H2,22,23,27)/t16-/m0/s1