ethyl 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate

Systemtic Name: ethyl 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate Openeye Name: ethyl 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate CAS Name: 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate Traditional Name: 2-(3-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester Formula: C25H23ClO4 MolecularWeight: 422.90072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H23ClO4/c1-2-28-23(27)25(21-14-9-15-22(26)16-21)29-17-24(18-30-25,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-16H,2,17-18H2,1H3