(3-nitrophenyl) 3-(2-phenoxyethoxy)benzoate

Systemtic Name: (3-nitrophenyl) 3-(2-phenoxyethoxy)benzoate Openeye Name: (3-nitrophenyl) 3-(2-phenoxyethoxy)benzoate CAS Name: 3-(2-phenoxyethoxy)benzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3-(2-phenoxyethoxy)benzoate Traditional Name: 3-(2-phenoxyethoxy)benzoic acid (3-nitrophenyl) ester Formula: C21H17NO6 MolecularWeight: 379.36278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17NO6/c23-21(28-20-11-5-7-17(15-20)22(24)25)16-6-4-10-19(14-16)27-13-12-26-18-8-2-1-3-9-18/h1-11,14-15H,12-13H2