ethyl 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate

Systemtic Name: ethyl 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate Openeye Name: ethyl 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate CAS Name: 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylate Traditional Name: 2-(3,4-dichlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carboxylic acid ethyl ester Formula: C25H22Cl2O4 MolecularWeight: 457.34578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22Cl2O4/c1-2-29-23(28)25(20-13-14-21(26)22(27)15-20)30-16-24(17-31-25,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3