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

Systemtic Name: 1-(3,5-dimethylphenyl)-9-[(E)-4-(3,5-dimethylphenyl)but-1-en-3-ynyl]phenanthrene Openeye Name: 1-(3,5-dimethylphenyl)-9-[(E)-4-(3,5-dimethylphenyl)but-1-en-3-ynyl]phenanthrene CAS Name: 1-(3,5-dimethylphenyl)-9-[(E)-4-(3,5-dimethylphenyl)but-1-en-3-ynyl]phenanthrene IUPAC Name: 1-(3,5-dimethylphenyl)-9-[(E)-4-(3,5-dimethylphenyl)but-1-en-3-ynyl]phenanthrene Traditional Name: 1-(3,5-dimethylphenyl)-9-[(E)-4-(3,5-dimethylphenyl)but-1-en-3-ynyl]phenanthrene Formula: C34H28 MolecularWeight: 436.58612

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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)C)C)C5=CC=CC=C52)C

Isomeric SMILES

CC1=CC(=CC(=C1)C#C/C=C/C2=CC3=C(C=CC=C3C4=CC(=CC(=C4)C)C)C5=CC=CC=C52)C

InChI

InChI=1S/C34H28/c1-23-16-24(2)19-27(18-23)10-5-6-11-28-22-34-31(29-20-25(3)17-26(4)21-29)14-9-15-33(34)32-13-8-7-12-30(28)32/h6-9,11-22H,1-4H3/b11-6+