(4-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate

Systemtic Name: (4-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate Openeye Name: (4-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate CAS Name: 3-(2,3-dicyanophenoxy)benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate Traditional Name: 3-(2,3-dicyanophenoxy)benzoic acid (4-nitrobenzyl) ester Formula: C22H13N3O5 MolecularWeight: 399.35572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC=CC(=C2C#N)C#N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC=CC(=C2C#N)C#N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

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