(2-ethyl-5-nitro-phenyl) thiocyanate

Systemtic Name: (2-ethyl-5-nitro-phenyl) thiocyanate Openeye Name: (2-ethyl-5-nitro-phenyl) thiocyanate CAS Name: thiocyanic acid (2-ethyl-5-nitrophenyl) ester IUPAC Name: (2-ethyl-5-nitrophenyl) thiocyanate Traditional Name: thiocyanic acid (2-ethyl-5-nitro-phenyl) ester Formula: C9H8N2O2S MolecularWeight: 208.23702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)[N+](=O)[O-])SC#N

Isomeric SMILES

CCC1=C(C=C(C=C1)[N+](=O)[O-])SC#N

InChI

InChI=1S/C9H8N2O2S/c1-2-7-3-4-8(11(12)13)5-9(7)14-6-10/h3-5H,2H2,1H3