4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate

Systemtic Name: 4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate Openeye Name: 4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate CAS Name: 4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate IUPAC Name: 4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate Traditional Name: 4-phenylbicyclo[3.1.0]hexa-1(6),2,4-triene dicyanate hydrate Formula: C14H10N2O3-2 MolecularWeight: 254.2408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C3C=C2.C(#N)[O-].C(#N)[O-].O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C3C=C2.C(#N)[O-].C(#N)[O-].O

InChI

InChI=1S/C12H8.2CHNO.H2O/c1-2-4-9(5-3-1)11-7-6-10-8-12(10)11;2*2-1-3;/h1-8H;2*3H;1H2/p-2