(4-nitrophenyl)methyl 4-(3,4-dicyanophenoxy)benzoate

Systemtic Name: (4-nitrophenyl)methyl 4-(3,4-dicyanophenoxy)benzoate Openeye Name: (4-nitrophenyl)methyl 4-(3,4-dicyanophenoxy)benzoate CAS Name: 4-(3,4-dicyanophenoxy)benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-(3,4-dicyanophenoxy)benzoate Traditional Name: 4-(3,4-dicyanophenoxy)benzoic acid (4-nitrobenzyl) ester Formula: C22H13N3O5 MolecularWeight: 399.35572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C22H13N3O5/c23-12-17-5-10-21(11-18(17)13-24)30-20-8-3-16(4-9-20)22(26)29-14-15-1-6-19(7-2-15)25(27)28/h1-11H,14H2