[3-(2-phenoxyethoxycarbonyl)phenyl] 2-nitrobenzoate

Systemtic Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 2-nitrobenzoate Openeye Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [3-[oxo(2-phenoxyethoxy)methyl]phenyl] ester IUPAC Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [3-(2-phenoxyethoxycarbonyl)phenyl] ester Formula: C22H17NO7 MolecularWeight: 407.37288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H17NO7/c24-21(29-14-13-28-17-8-2-1-3-9-17)16-7-6-10-18(15-16)30-22(25)19-11-4-5-12-20(19)23(26)27/h1-12,15H,13-14H2