9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenyl-phenanthrene

Systemtic Name: 9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenyl-phenanthrene Openeye Name: 9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenyl-phenanthrene CAS Name: 9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenylphenanthrene IUPAC Name: 9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenylphenanthrene Traditional Name: 9-[4-(3,5-dimethylphenyl)but-1-en-3-ynyl]-1-phenyl-phenanthrene Formula: C32H24 MolecularWeight: 408.53296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#CC=CC2=CC3=C(C=CC=C3C4=CC=CC=C4)C5=CC=CC=C52)C

Isomeric SMILES

CC1=CC(=CC(=C1)C#CC=CC2=CC3=C(C=CC=C3C4=CC=CC=C4)C5=CC=CC=C52)C

InChI

InChI=1S/C32H24/c1-23-19-24(2)21-25(20-23)11-6-7-14-27-22-32-28(26-12-4-3-5-13-26)17-10-18-31(32)30-16-9-8-15-29(27)30/h3-5,7-10,12-22H,1-2H3