(4,4,5,5-tetracyano-2-methyl-cyclohexen-1-yl) thiocyanate

Systemtic Name: (4,4,5,5-tetracyano-2-methyl-cyclohexen-1-yl) thiocyanate Openeye Name: (4,4,5,5-tetracyano-2-methyl-cyclohexen-1-yl) thiocyanate CAS Name: thiocyanic acid (4,4,5,5-tetracyano-2-methyl-1-cyclohexenyl) ester IUPAC Name: (4,4,5,5-tetracyano-2-methylcyclohexen-1-yl) thiocyanate Traditional Name: thiocyanic acid (4,4,5,5-tetracyano-2-methyl-cyclohexen-1-yl) ester Formula: C12H7N5S MolecularWeight: 253.28248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)(C#N)C#N)(C#N)C#N)SC#N

Isomeric SMILES

CC1=C(CC(C(C1)(C#N)C#N)(C#N)C#N)SC#N

InChI

InChI=1S/C12H7N5S/c1-9-2-11(4-13,5-14)12(6-15,7-16)3-10(9)18-8-17/h2-3H2,1H3