2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; methyl 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylate

Systemtic Name: 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; methyl 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylate Openeye Name: 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; methyl 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylate CAS Name: 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid methyl ester IUPAC Name: 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; methyl 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylate Traditional Name: 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid; 2-methyl-5,5-diphenyl-1,3-dioxane-2-carboxylic acid methyl ester Formula: C37H38O8 MolecularWeight: 610.69282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.CC1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.CC1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C19H20O4.C18H18O4/c1-18(17(20)21-2)22-13-19(14-23-18,15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-17(16(19)20)21-12-18(13-22-17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h3-12H,13-14H2,1-2H3;2-11H,12-13H2,1H3,(H,19,20)