(2S,3S)-2-phenyl-3-(2-phenylethynyl)cyclohexan-1-one

Systemtic Name: (2S,3S)-2-phenyl-3-(2-phenylethynyl)cyclohexan-1-one Openeye Name: (2S,3S)-2-phenyl-3-(2-phenylethynyl)cyclohexanone CAS Name: (2S,3S)-2-phenyl-3-(2-phenylethynyl)-1-cyclohexanone IUPAC Name: (2S,3S)-2-phenyl-3-(2-phenylethynyl)cyclohexan-1-one Traditional Name: (2S,3S)-2-phenyl-3-(2-phenylethynyl)cyclohexanone Formula: C20H18O MolecularWeight: 274.35632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(=O)C1)C2=CC=CC=C2)C#CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]([C@H](C(=O)C1)C2=CC=CC=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C20H18O/c21-19-13-7-12-18(15-14-16-8-3-1-4-9-16)20(19)17-10-5-2-6-11-17/h1-6,8-11,18,20H,7,12-13H2/t18-,20-/m1/s1