(4-hexoxyphenyl) 4-nitrobenzoate

Systemtic Name: (4-hexoxyphenyl) 4-nitrobenzoate Openeye Name: (4-hexoxyphenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-hexoxyphenyl) ester Formula: C19H21NO5 MolecularWeight: 343.37374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21NO5/c1-2-3-4-5-14-24-17-10-12-18(13-11-17)25-19(21)15-6-8-16(9-7-15)20(22)23/h6-13H,2-5,14H2,1H3