[(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [(1S)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid [(2S)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid [(1S)-2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22ClN3O5 MolecularWeight: 383.82668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)CCNC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)OC(=O)CCNC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C17H22ClN3O5/c1-10(2)20-17(25)21-15(23)11(3)26-14(22)8-9-19-16(24)12-4-6-13(18)7-5-12/h4-7,10-11H,8-9H2,1-3H3,(H,19,24)(H2,20,21,23,25)/t11-/m0/s1