(4-azanyl-5-methyl-2-nitro-phenyl) thiocyanate

Systemtic Name: (4-azanyl-5-methyl-2-nitro-phenyl) thiocyanate Openeye Name: (4-amino-5-methyl-2-nitro-phenyl) thiocyanate CAS Name: thiocyanic acid (4-amino-5-methyl-2-nitrophenyl) ester IUPAC Name: (4-amino-5-methyl-2-nitrophenyl) thiocyanate Traditional Name: thiocyanic acid (4-amino-5-methyl-2-nitro-phenyl) ester Formula: C8H7N3O2S MolecularWeight: 209.22508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)[N+](=O)[O-])SC#N

Isomeric SMILES

CC1=CC(=C(C=C1N)[N+](=O)[O-])SC#N

InChI

InChI=1S/C8H7N3O2S/c1-5-2-8(14-4-9)7(11(12)13)3-6(5)10/h2-3H,10H2,1H3