17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene

Systemtic Name: 17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene Openeye Name: 17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene CAS Name: 17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene IUPAC Name: 17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene Traditional Name: 17-[2-(4-phenylphenyl)ethynyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene Formula: C28H28O5 MolecularWeight: 444.51892

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOC2=C(C=C(C=C2)C#CC3=CC=C(C=C3)C4=CC=CC=C4)OCCOCCO1

Isomeric SMILES

C1COCCOC2=C(C=C(C=C2)C#CC3=CC=C(C=C3)C4=CC=CC=C4)OCCOCCO1

InChI

InChI=1S/C28H28O5/c1-2-4-25(5-3-1)26-11-8-23(9-12-26)6-7-24-10-13-27-28(22-24)33-21-19-31-17-15-29-14-16-30-18-20-32-27/h1-5,8-13,22H,14-21H2