[3-(2,2-dimethylpropanoyloxy)-2-(1,10-phenanthrolin-2-yl)phenyl] 2,2-dimethylpropanoate

Systemtic Name: [3-(2,2-dimethylpropanoyloxy)-2-(1,10-phenanthrolin-2-yl)phenyl] 2,2-dimethylpropanoate Openeye Name: [3-(2,2-dimethylpropanoyloxy)-2-(1,10-phenanthrolin-2-yl)phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-(2,2-dimethyl-1-oxopropoxy)-2-(1,10-phenanthrolin-2-yl)phenyl] ester IUPAC Name: [3-(2,2-dimethylpropanoyloxy)-2-(1,10-phenanthrolin-2-yl)phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-(1,10-phenanthrolin-2-yl)-3-pivaloyloxy-phenyl] ester Formula: C28H28N2O4 MolecularWeight: 456.53292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C(=CC=C1)OC(=O)C(C)(C)C)C2=NC3=C(C=CC4=C3N=CC=C4)C=C2

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C(=CC=C1)OC(=O)C(C)(C)C)C2=NC3=C(C=CC4=C3N=CC=C4)C=C2

InChI

InChI=1S/C28H28N2O4/c1-27(2,3)25(31)33-20-10-7-11-21(34-26(32)28(4,5)6)22(20)19-15-14-18-13-12-17-9-8-16-29-23(17)24(18)30-19/h7-16H,1-6H3