(4-butan-2-ylphenyl) 2-(4-nitrophenoxy)ethanoate

Systemtic Name: (4-butan-2-ylphenyl) 2-(4-nitrophenoxy)ethanoate Openeye Name: (4-sec-butylphenyl) 2-(4-nitrophenoxy)acetate CAS Name: 2-(4-nitrophenoxy)acetic acid (4-butan-2-ylphenyl) ester IUPAC Name: (4-butan-2-ylphenyl) 2-(4-nitrophenoxy)acetate Traditional Name: 2-(4-nitrophenoxy)acetic acid (4-sec-butylphenyl) ester Formula: C18H19NO5 MolecularWeight: 329.34716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5/c1-3-13(2)14-4-8-17(9-5-14)24-18(20)12-23-16-10-6-15(7-11-16)19(21)22/h4-11,13H,3,12H2,1-2H3