(2S,5S)-2,5-bis(1-adamantyl)cyclopentan-1-one

Systemtic Name: (2S,5S)-2,5-bis(1-adamantyl)cyclopentan-1-one Openeye Name: (2S,5S)-2,5-bis(1-adamantyl)cyclopentanone CAS Name: (2S,5S)-2,5-bis(1-adamantyl)-1-cyclopentanone IUPAC Name: (2S,5S)-2,5-bis(1-adamantyl)cyclopentan-1-one Traditional Name: (2S,5S)-2,5-bis(1-adamantyl)cyclopentanone Formula: C25H36O MolecularWeight: 352.55274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1C[C@H](C(=O)[C@@H]1C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C25H36O/c26-23-21(24-9-15-3-16(10-24)5-17(4-15)11-24)1-2-22(23)25-12-18-6-19(13-25)8-20(7-18)14-25/h15-22H,1-14H2/t15?,16?,17?,18?,19?,20?,21-,22-,24?,25?/m1/s1