(4-azanyl-3-nitro-phenyl) thiocyanate

Systemtic Name: (4-azanyl-3-nitro-phenyl) thiocyanate Openeye Name: (4-amino-3-nitro-phenyl) thiocyanate CAS Name: thiocyanic acid (4-amino-3-nitrophenyl) ester IUPAC Name: (4-amino-3-nitrophenyl) thiocyanate Traditional Name: thiocyanic acid (4-amino-3-nitro-phenyl) ester Formula: C7H5N3O2S MolecularWeight: 195.1985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC#N)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1SC#N)[N+](=O)[O-])N

InChI

InChI=1S/C7H5N3O2S/c8-4-13-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2