ethyl 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylate

Systemtic Name: ethyl 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylate Openeye Name: ethyl 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylate CAS Name: 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylate Traditional Name: 2-cyclohexyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester Formula: C25H30O4 MolecularWeight: 394.5033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C25H30O4/c1-2-27-23(26)25(22-16-10-5-11-17-22)28-18-24(19-29-25,20-12-6-3-7-13-20)21-14-8-4-9-15-21/h3-4,6-9,12-15,22H,2,5,10-11,16-19H2,1H3