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

Systemtic Name: [3-(2,2-dicyanoethenyl)phenyl] 4-isocyanobenzenesulfonate Openeye Name: [3-(2,2-dicyanovinyl)phenyl] 4-isocyanobenzenesulfonate CAS Name: 4-isocyanobenzenesulfonic acid [3-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [3-(2,2-dicyanoethenyl)phenyl] 4-isocyanobenzenesulfonate Traditional Name: 4-isocyanobenzenesulfonic acid [3-(2,2-dicyanovinyl)phenyl] ester Formula: C17H9N3O3S MolecularWeight: 335.33666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H9N3O3S/c1-20-15-5-7-17(8-6-15)24(21,22)23-16-4-2-3-13(10-16)9-14(11-18)12-19/h2-10H