[3-bromanyl-5-(3-bromanyl-2-oxidanyl-5-thiocyanato-phenyl)-4-oxidanyl-phenyl] thiocyanate

Systemtic Name: [3-bromanyl-5-(3-bromanyl-2-oxidanyl-5-thiocyanato-phenyl)-4-oxidanyl-phenyl] thiocyanate Openeye Name: [3-bromo-5-(3-bromo-2-hydroxy-5-thiocyanato-phenyl)-4-hydroxy-phenyl] thiocyanate CAS Name: thiocyanic acid [3-bromo-5-(3-bromo-2-hydroxy-5-thiocyanatophenyl)-4-hydroxyphenyl] ester IUPAC Name: [3-bromo-5-(3-bromo-2-hydroxy-5-thiocyanatophenyl)-4-hydroxyphenyl] thiocyanate Traditional Name: thiocyanic acid [3-bromo-5-(3-bromo-2-hydroxy-5-thiocyanato-phenyl)-4-hydroxy-phenyl] ester Formula: C14H6Br2N2O2S2 MolecularWeight: 458.14764

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)O)C2=CC(=CC(=C2O)Br)SC#N)SC#N

Isomeric SMILES

C1=C(C=C(C(=C1Br)O)C2=CC(=CC(=C2O)Br)SC#N)SC#N

InChI

InChI=1S/C14H6Br2N2O2S2/c15-11-3-7(21-5-17)1-9(13(11)19)10-2-8(22-6-18)4-12(16)14(10)20/h1-4,19-20H