(4-nitrophenyl) 2-[3-(3-methylbutoxy)phenoxy]ethanoate

Systemtic Name: (4-nitrophenyl) 2-[3-(3-methylbutoxy)phenoxy]ethanoate Openeye Name: (4-nitrophenyl) 2-(3-isopentyloxyphenoxy)acetate CAS Name: 2-[3-(3-methylbutoxy)phenoxy]acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[3-(3-methylbutoxy)phenoxy]acetate Traditional Name: 2-(3-isoamoxyphenoxy)acetic acid (4-nitrophenyl) ester Formula: C19H21NO6 MolecularWeight: 359.37314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)OCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)OCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21NO6/c1-14(2)10-11-24-17-4-3-5-18(12-17)25-13-19(21)26-16-8-6-15(7-9-16)20(22)23/h3-9,12,14H,10-11,13H2,1-2H3