[4-(2,2-dicyanoethenyl)phenyl] 4-nitrobenzoate

Systemtic Name: [4-(2,2-dicyanoethenyl)phenyl] 4-nitrobenzoate Openeye Name: [4-(2,2-dicyanovinyl)phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-(2,2-dicyanovinyl)phenyl] ester Formula: C17H9N3O4 MolecularWeight: 319.27106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C#N)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=C(C#N)C#N)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H9N3O4/c18-10-13(11-19)9-12-1-7-16(8-2-12)24-17(21)14-3-5-15(6-4-14)20(22)23/h1-9H