bis(phenylmethyl) 2-[(1S,2S)-2-(7-methoxy-1-oxidanyl-7-oxidanylidene-heptyl)-3-oxidanylidene-cyclopentyl]-2-methyl-propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(1S,2S)-2-(7-methoxy-1-oxidanyl-7-oxidanylidene-heptyl)-3-oxidanylidene-cyclopentyl]-2-methyl-propanedioate Openeye Name: dibenzyl 2-[(1S,2S)-2-(1-hydroxy-7-methoxy-7-oxo-heptyl)-3-oxo-cyclopentyl]-2-methyl-propanedioate CAS Name: 2-[(1S,2S)-2-(1-hydroxy-7-methoxy-7-oxoheptyl)-3-oxocyclopentyl]-2-methylpropanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(1S,2S)-2-(1-hydroxy-7-methoxy-7-oxoheptyl)-3-oxocyclopentyl]-2-methylpropanedioate Traditional Name: 2-[(1S,2S)-2-(1-hydroxy-7-keto-7-methoxy-heptyl)-3-keto-cyclopentyl]-2-methyl-malonic acid dibenzyl ester Formula: C31H38O8 MolecularWeight: 538.62862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC(=O)C1C(CCCCCC(=O)OC)O)(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C31H38O8/c1-31(29(35)38-20-22-12-6-3-7-13-22,30(36)39-21-23-14-8-4-9-15-23)24-18-19-26(33)28(24)25(32)16-10-5-11-17-27(34)37-2/h3-4,6-9,12-15,24-25,28,32H,5,10-11,16-21H2,1-2H3/t24-,25?,28-/m0/s1