16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene

Systemtic Name: 16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene Openeye Name: 16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene CAS Name: 16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene IUPAC Name: 16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene Traditional Name: 16-phenyl-15-(2-phenylethynyl)bicyclo[12.3.1]octadeca-1(18),14,16-triene Formula: C32H36 MolecularWeight: 420.62824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCC2=C(C(=CC(=C2)CCCCC1)C3=CC=CC=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCCCCCC2=C(C(=CC(=C2)CCCCC1)C3=CC=CC=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C32H36/c1-2-4-6-8-14-22-30-25-28(19-11-7-5-3-1)26-32(29-20-15-10-16-21-29)31(30)24-23-27-17-12-9-13-18-27/h9-10,12-13,15-18,20-21,25-26H,1-8,11,14,19,22H2