(3-nitrophenyl) 4-isocyanobenzenesulfinate

Systemtic Name: (3-nitrophenyl) 4-isocyanobenzenesulfinate Openeye Name: (3-nitrophenyl) 4-isocyanobenzenesulfinate CAS Name: 4-isocyanobenzenesulfinic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 4-isocyanobenzenesulfinate Traditional Name: 4-isocyanobenzenesulfinic acid (3-nitrophenyl) ester Formula: C13H8N2O4S MolecularWeight: 288.27862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O4S/c1-14-10-5-7-13(8-6-10)20(18)19-12-4-2-3-11(9-12)15(16)17/h2-9H