(3R)-3-(4-tert-butylphenyl)-3-[2-(2,5-dimethylphenoxy)ethanoylamino]propanoate

Systemtic Name: (3R)-3-(4-tert-butylphenyl)-3-[2-(2,5-dimethylphenoxy)ethanoylamino]propanoate Openeye Name: (3R)-3-(4-tert-butylphenyl)-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]propanoate CAS Name: (3R)-3-(4-tert-butylphenyl)-3-[[2-(2,5-dimethylphenoxy)-1-oxoethyl]amino]propanoate IUPAC Name: (3R)-3-(4-tert-butylphenyl)-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]propanoate Traditional Name: (3R)-3-(4-tert-butylphenyl)-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]propionate Formula: C23H28NO4- MolecularWeight: 382.47272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC(CC(=O)[O-])C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)N[C@H](CC(=O)[O-])C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H29NO4/c1-15-6-7-16(2)20(12-15)28-14-21(25)24-19(13-22(26)27)17-8-10-18(11-9-17)23(3,4)5/h6-12,19H,13-14H2,1-5H3,(H,24,25)(H,26,27)/p-1/t19-/m1/s1