3,5-bis[2-(2,4-dimethylphenoxy)ethanoylamino]benzoate

Systemtic Name: 3,5-bis[2-(2,4-dimethylphenoxy)ethanoylamino]benzoate Openeye Name: 3,5-bis[[2-(2,4-dimethylphenoxy)acetyl]amino]benzoate CAS Name: 3,5-bis[[2-(2,4-dimethylphenoxy)-1-oxoethyl]amino]benzoate IUPAC Name: 3,5-bis[[2-(2,4-dimethylphenoxy)acetyl]amino]benzoate Traditional Name: 3,5-bis[[2-(2,4-dimethylphenoxy)acetyl]amino]benzoate Formula: C27H27N2O6- MolecularWeight: 475.51308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])NC(=O)COC3=C(C=C(C=C3)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])NC(=O)COC3=C(C=C(C=C3)C)C)C

InChI

InChI=1S/C27H28N2O6/c1-16-5-7-23(18(3)9-16)34-14-25(30)28-21-11-20(27(32)33)12-22(13-21)29-26(31)15-35-24-8-6-17(2)10-19(24)4/h5-13H,14-15H2,1-4H3,(H,28,30)(H,29,31)(H,32,33)/p-1