prop-2-ynyl (2R,6S)-1-cyano-4-oxidanylidene-2,6-diphenyl-cyclohexane-1-carboxylate

Systemtic Name: prop-2-ynyl (2R,6S)-1-cyano-4-oxidanylidene-2,6-diphenyl-cyclohexane-1-carboxylate Openeye Name: prop-2-ynyl (2R,6S)-1-cyano-4-oxo-2,6-diphenyl-cyclohexanecarboxylate CAS Name: (2R,6S)-1-cyano-4-oxo-2,6-diphenyl-1-cyclohexanecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl (2R,6S)-1-cyano-4-oxo-2,6-diphenylcyclohexane-1-carboxylate Traditional Name: (2R,6S)-1-cyano-4-keto-2,6-diphenyl-cyclohexanecarboxylic acid propargyl ester Formula: C23H19NO3 MolecularWeight: 357.40186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO3/c1-2-13-27-22(26)23(16-24)20(17-9-5-3-6-10-17)14-19(25)15-21(23)18-11-7-4-8-12-18/h1,3-12,20-21H,13-15H2/t20-,21+,23?