methyl (5R,9S,12R,13R)-5,9-dimethyl-2-oxidanyl-10,13-bis(phenylmethoxy)-12-propan-2-yl-cyclotetradecane-1-carboxylate

Systemtic Name: methyl (5R,9S,12R,13R)-5,9-dimethyl-2-oxidanyl-10,13-bis(phenylmethoxy)-12-propan-2-yl-cyclotetradecane-1-carboxylate Openeye Name: methyl (5R,9S,12R,13R)-10,13-dibenzyloxy-2-hydroxy-12-isopropyl-5,9-dimethyl-cyclotetradecanecarboxylate CAS Name: (5R,9S,12R,13R)-2-hydroxy-5,9-dimethyl-10,13-bis(phenylmethoxy)-12-propan-2-yl-1-cyclotetradecanecarboxylic acid methyl ester IUPAC Name: methyl (5R,9S,12R,13R)-2-hydroxy-5,9-dimethyl-10,13-bis(phenylmethoxy)-12-propan-2-ylcyclotetradecane-1-carboxylate Traditional Name: (5R,9S,12R,13R)-10,13-dibenzoxy-2-hydroxy-12-isopropyl-5,9-dimethyl-cyclotetradecanecarboxylic acid methyl ester Formula: C35H52O5 MolecularWeight: 552.78438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C(CC(C(CC(C(CC1)O)C(=O)OC)OCC2=CC=CC=C2)C(C)C)OCC3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1CCC[C@@H](C(C[C@@H]([C@@H](CC(C(CC1)O)C(=O)OC)OCC2=CC=CC=C2)C(C)C)OCC3=CC=CC=C3)C

InChI

InChI=1S/C35H52O5/c1-25(2)30-21-33(39-23-28-15-8-6-9-16-28)27(4)14-12-13-26(3)19-20-32(36)31(35(37)38-5)22-34(30)40-24-29-17-10-7-11-18-29/h6-11,15-18,25-27,30-34,36H,12-14,19-24H2,1-5H3/t26-,27+,30-,31?,32?,33?,34-/m1/s1