(4-nitrophenyl) 2,2-diphenoxy-2-(4-propylphenoxy)ethanoate

Systemtic Name: (4-nitrophenyl) 2,2-diphenoxy-2-(4-propylphenoxy)ethanoate Openeye Name: (4-nitrophenyl) 2,2-diphenoxy-2-(4-propylphenoxy)acetate CAS Name: 2,2-diphenoxy-2-(4-propylphenoxy)acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2,2-diphenoxy-2-(4-propylphenoxy)acetate Traditional Name: 2,2-diphenoxy-2-(4-propylphenoxy)acetic acid (4-nitrophenyl) ester Formula: C29H25NO7 MolecularWeight: 499.5113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H25NO7/c1-2-9-22-14-18-27(19-15-22)37-29(35-25-10-5-3-6-11-25,36-26-12-7-4-8-13-26)28(31)34-24-20-16-23(17-21-24)30(32)33/h3-8,10-21H,2,9H2,1H3