[(2S)-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] 4-oxidanylidenepentanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] 4-oxidanylidenepentanoate Openeye Name: [(1S)-2-(4-isopropylanilino)-1-methyl-2-oxo-ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [(2S)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [(1S)-2-cumidino-2-keto-1-methyl-ethyl] ester Formula: C17H23NO4 MolecularWeight: 305.36882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(C)C)OC(=O)CCC(=O)C

InChI

InChI=1S/C17H23NO4/c1-11(2)14-6-8-15(9-7-14)18-17(21)13(4)22-16(20)10-5-12(3)19/h6-9,11,13H,5,10H2,1-4H3,(H,18,21)/t13-/m0/s1