(E,2S,3S)-2-bromanyl-3,6,9-triphenyl-non-8-en-4-yn-3-ol

Systemtic Name: (E,2S,3S)-2-bromanyl-3,6,9-triphenyl-non-8-en-4-yn-3-ol Openeye Name: (E,2S,3S)-2-bromo-3,6,9-triphenyl-non-8-en-4-yn-3-ol CAS Name: (E,2S,3S)-2-bromo-3,6,9-triphenyl-3-non-8-en-4-ynol IUPAC Name: (E,2S,3S)-2-bromo-3,6,9-triphenylnon-8-en-4-yn-3-ol Traditional Name: (E,2S,3S)-2-bromo-3,6,9-triphenyl-non-8-en-4-yn-3-ol Formula: C27H25BrO MolecularWeight: 445.3908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#CC(CC=CC1=CC=CC=C1)C2=CC=CC=C2)(C3=CC=CC=C3)O)Br

Isomeric SMILES

C[C@@H]([C@@](C#CC(C/C=C/C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC=CC=C3)O)Br

InChI

InChI=1S/C27H25BrO/c1-22(28)27(29,26-18-9-4-10-19-26)21-20-25(24-15-7-3-8-16-24)17-11-14-23-12-5-2-6-13-23/h2-16,18-19,22,25,29H,17H2,1H3/b14-11+/t22-,25?,27-/m0/s1