6-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-3,3-dimethyl-cyclohexa-1,4-diene

Systemtic Name: 6-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-3,3-dimethyl-cyclohexa-1,4-diene Openeye Name: 3,3-dimethyl-6-[3-phenyl-1-(2-phenylethynyl)prop-2-ynylidene]cyclohexa-1,4-diene CAS Name: 6-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-3,3-dimethylcyclohexa-1,4-diene IUPAC Name: 6-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-3,3-dimethylcyclohexa-1,4-diene Traditional Name: 3,3-dimethyl-6-[3-phenyl-1-(2-phenylethynyl)prop-2-ynylidene]cyclohexa-1,4-diene Formula: C25H20 MolecularWeight: 320.4263

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=C(C#CC2=CC=CC=C2)C#CC3=CC=CC=C3)C=C1)C

Isomeric SMILES

CC1(C=CC(=C(C#CC2=CC=CC=C2)C#CC3=CC=CC=C3)C=C1)C

InChI

InChI=1S/C25H20/c1-25(2)19-17-24(18-20-25)23(15-13-21-9-5-3-6-10-21)16-14-22-11-7-4-8-12-22/h3-12,17-20H,1-2H3