phenyl 4-isocyanobenzenesulfinate

Systemtic Name: phenyl 4-isocyanobenzenesulfinate Openeye Name: phenyl 4-isocyanobenzenesulfinate CAS Name: 4-isocyanobenzenesulfinic acid phenyl ester IUPAC Name: phenyl 4-isocyanobenzenesulfinate Traditional Name: 4-isocyanobenzenesulfinic acid phenyl ester Formula: C13H9NO2S MolecularWeight: 243.28106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9NO2S/c1-14-11-7-9-13(10-8-11)17(15)16-12-5-3-2-4-6-12/h2-10H