[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl] thiocyanate

Systemtic Name: [3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl] thiocyanate Openeye Name: (3,6-dioxocyclohexa-1,4-dien-1-yl) thiocyanate CAS Name: thiocyanic acid (3,6-dioxo-1-cyclohexa-1,4-dienyl) ester IUPAC Name: (3,6-dioxocyclohexa-1,4-dien-1-yl) thiocyanate Traditional Name: thiocyanic acid (3,6-diketocyclohexa-1,4-dien-1-yl) ester Formula: C7H3NO2S MolecularWeight: 165.16922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H3NO2S/c8-4-11-7-3-5(9)1-2-6(7)10/h1-3H