[2-oxidanylidene-2-(4-propylphenyl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(4-propylphenyl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-oxo-2-(4-propylphenyl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [2-oxo-2-(4-propylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propylphenyl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-keto-2-(4-propylphenyl)ethyl] ester Formula: C24H29NO4 MolecularWeight: 395.49136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C24H29NO4/c1-4-8-18-11-13-20(14-12-18)21(26)16-29-24(28)23(17(2)3)25-22(27)15-19-9-6-5-7-10-19/h5-7,9-14,17,23H,4,8,15-16H2,1-3H3,(H,25,27)/t23-/m0/s1