tert-butyl (2R,6S)-1-cyano-4-oxidanylidene-2,6-diphenyl-cyclohexane-1-carboxylate

Systemtic Name: tert-butyl (2R,6S)-1-cyano-4-oxidanylidene-2,6-diphenyl-cyclohexane-1-carboxylate Openeye Name: tert-butyl (2R,6S)-1-cyano-4-oxo-2,6-diphenyl-cyclohexanecarboxylate CAS Name: (2R,6S)-1-cyano-4-oxo-2,6-diphenyl-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,6S)-1-cyano-4-oxo-2,6-diphenylcyclohexane-1-carboxylate Traditional Name: (2R,6S)-1-cyano-4-keto-2,6-diphenyl-cyclohexanecarboxylic acid tert-butyl ester Formula: C24H25NO3 MolecularWeight: 375.4602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(C(CC(=O)CC1C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1([C@H](CC(=O)C[C@H]1C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H25NO3/c1-23(2,3)28-22(27)24(16-25)20(17-10-6-4-7-11-17)14-19(26)15-21(24)18-12-8-5-9-13-18/h4-13,20-21H,14-15H2,1-3H3/t20-,21+,24?