phenacyl 2,2-dicyclohexyl-2-oxidanyl-ethanoate

Systemtic Name: phenacyl 2,2-dicyclohexyl-2-oxidanyl-ethanoate Openeye Name: phenacyl 2,2-dicyclohexyl-2-hydroxy-acetate CAS Name: 2,2-dicyclohexyl-2-hydroxyacetic acid phenacyl ester IUPAC Name: phenacyl 2,2-dicyclohexyl-2-hydroxyacetate Traditional Name: 2,2-dicyclohexyl-2-hydroxy-acetic acid phenacyl ester Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2CCCCC2)(C(=O)OCC(=O)C3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)C(C2CCCCC2)(C(=O)OCC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H30O4/c23-20(17-10-4-1-5-11-17)16-26-21(24)22(25,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1,4-5,10-11,18-19,25H,2-3,6-9,12-16H2