ethyl (3R,4S)-3-methyl-6,6-bis(4-methylphenyl)-3-oxidanyl-1,2-dioxane-4-carboxylate

Systemtic Name: ethyl (3R,4S)-3-methyl-6,6-bis(4-methylphenyl)-3-oxidanyl-1,2-dioxane-4-carboxylate Openeye Name: ethyl (3R,4S)-3-hydroxy-3-methyl-6,6-bis(p-tolyl)dioxane-4-carboxylate CAS Name: (3R,4S)-3-hydroxy-3-methyl-6,6-bis(4-methylphenyl)-4-dioxanecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4S)-3-hydroxy-3-methyl-6,6-bis(4-methylphenyl)dioxane-4-carboxylate Traditional Name: (3R,4S)-3-hydroxy-3-methyl-6,6-bis(p-tolyl)dioxane-4-carboxylic acid ethyl ester Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(OOC1(C)O)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)[C@H]1CC(OO[C@@]1(C)O)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26O5/c1-5-25-20(23)19-14-22(27-26-21(19,4)24,17-10-6-15(2)7-11-17)18-12-8-16(3)9-13-18/h6-13,19,24H,5,14H2,1-4H3/t19-,21-/m1/s1