[3-(2,2-dicyanoethenyl)phenyl] 4-isocyanobenzoate

Systemtic Name: [3-(2,2-dicyanoethenyl)phenyl] 4-isocyanobenzoate Openeye Name: [3-(2,2-dicyanovinyl)phenyl] 4-isocyanobenzoate CAS Name: 4-isocyanobenzoic acid [3-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [3-(2,2-dicyanoethenyl)phenyl] 4-isocyanobenzoate Traditional Name: 4-isocyanobenzoic acid [3-(2,2-dicyanovinyl)phenyl] ester Formula: C18H9N3O2 MolecularWeight: 299.28296

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C=C(C#N)C#N

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C=C(C#N)C#N

InChI

InChI=1S/C18H9N3O2/c1-21-16-7-5-15(6-8-16)18(22)23-17-4-2-3-13(10-17)9-14(11-19)12-20/h2-10H