(4S,6R)-2-methyl-5-phenylmethoxy-4,6-bis(phenylmethoxymethyl)-1,3-dioxane-2-carbonitrile

Systemtic Name: (4S,6R)-2-methyl-5-phenylmethoxy-4,6-bis(phenylmethoxymethyl)-1,3-dioxane-2-carbonitrile Openeye Name: (4S,6R)-5-benzyloxy-4,6-bis(benzyloxymethyl)-2-methyl-1,3-dioxane-2-carbonitrile CAS Name: (4S,6R)-2-methyl-5-phenylmethoxy-4,6-bis(phenylmethoxymethyl)-1,3-dioxane-2-carbonitrile IUPAC Name: (4S,6R)-2-methyl-5-phenylmethoxy-4,6-bis(phenylmethoxymethyl)-1,3-dioxane-2-carbonitrile Traditional Name: (4S,6R)-5-benzoxy-4,6-bis(benzoxymethyl)-2-methyl-1,3-dioxane-2-carbonitrile Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(C(C(O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)COCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1(O[C@@H](C([C@@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)COCC4=CC=CC=C4)C#N

InChI

InChI=1S/C29H31NO5/c1-29(22-30)34-26(20-31-17-23-11-5-2-6-12-23)28(33-19-25-15-9-4-10-16-25)27(35-29)21-32-18-24-13-7-3-8-14-24/h2-16,26-28H,17-21H2,1H3/t26-,27+,28?,29?