6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene ethanoate

Systemtic Name: 6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene ethanoate Openeye Name: 6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene acetate CAS Name: 6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene acetate IUPAC Name: 6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene acetate Traditional Name: 6,6-diphenylbicyclo[3.1.1]hepta-1(7),2,4-triene acetate Formula: C21H17O2- MolecularWeight: 301.35848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC=C(C=C1)C2(C3=CC2=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)[O-].C1=CC=C(C=C1)C2(C3=CC2=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H14.C2H4O2/c1-3-8-15(9-4-1)19(16-10-5-2-6-11-16)17-12-7-13-18(19)14-17;1-2(3)4/h1-14H;1H3,(H,3,4)/p-1