(1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]octa-3,4-dien-1-ol

Systemtic Name: (1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]octa-3,4-dien-1-ol Openeye Name: (1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]octa-3,4-dien-1-ol CAS Name: (1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]-1-octa-3,4-dienol IUPAC Name: (1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]octa-3,4-dien-1-ol Traditional Name: (1R,2S)-5-ethyl-2-phenyl-1-[4-(2-phenylethynyl)phenyl]octa-3,4-dien-1-ol Formula: C30H30O MolecularWeight: 406.5586

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C=CC(C1=CC=CC=C1)C(C2=CC=C(C=C2)C#CC3=CC=CC=C3)O)CC

Isomeric SMILES

CCCC(=C=C[C@@H](C1=CC=CC=C1)[C@H](C2=CC=C(C=C2)C#CC3=CC=CC=C3)O)CC

InChI

InChI=1S/C30H30O/c1-3-11-24(4-2)20-23-29(27-14-9-6-10-15-27)30(31)28-21-18-26(19-22-28)17-16-25-12-7-5-8-13-25/h5-10,12-15,18-19,21-23,29-31H,3-4,11H2,1-2H3/t20?,29-,30-/m0/s1