[(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-tert-butylphenyl)propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-(4-tert-butylphenyl)propanoate Openeye Name: [(1S)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(4-tert-butylphenyl)propanoate CAS Name: 3-(4-tert-butylphenyl)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-tert-butylphenyl)propanoate Traditional Name: 3-(4-tert-butylphenyl)propionic acid [(1S)-2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)CCC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)OC(=O)CCC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C20H30N2O4/c1-13(2)21-19(25)22-18(24)14(3)26-17(23)12-9-15-7-10-16(11-8-15)20(4,5)6/h7-8,10-11,13-14H,9,12H2,1-6H3,(H2,21,22,24,25)/t14-/m0/s1