(1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)cyclohexan-1-amine

Systemtic Name: (1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)cyclohexan-1-amine Openeye Name: (1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)cyclohexanamine CAS Name: (1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)-1-cyclohexanamine IUPAC Name: (1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)cyclohexan-1-amine Traditional Name: [(1S,2R,6S)-2-phenyl-6-(2-phenylethynyl)cyclohexyl]amine Formula: C20H21N MolecularWeight: 275.38744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N/c21-20-18(15-14-16-8-3-1-4-9-16)12-7-13-19(20)17-10-5-2-6-11-17/h1-6,8-11,18-20H,7,12-13,21H2/t18-,19+,20+/m0/s1