dimethyl 2-[5-(4-fluoranylphenoxy)-4-phenylmethoxy-pentyl]-2-methylsulfonyl-nonanedioate

Systemtic Name: dimethyl 2-[5-(4-fluoranylphenoxy)-4-phenylmethoxy-pentyl]-2-methylsulfonyl-nonanedioate Openeye Name: dimethyl 2-[4-benzyloxy-5-(4-fluorophenoxy)pentyl]-2-methylsulfonyl-nonanedioate CAS Name: 2-[5-(4-fluorophenoxy)-4-phenylmethoxypentyl]-2-methylsulfonylnonanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[5-(4-fluorophenoxy)-4-phenylmethoxypentyl]-2-methylsulfonylnonanedioate Traditional Name: 2-[4-benzoxy-5-(4-fluorophenoxy)pentyl]-2-mesyl-azelaic acid dimethyl ester Formula: C30H41FO8S MolecularWeight: 580.705143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(CCCC(COC1=CC=C(C=C1)F)OCC2=CC=CC=C2)(C(=O)OC)S(=O)(=O)C

Isomeric SMILES

COC(=O)CCCCCCC(CCCC(COC1=CC=C(C=C1)F)OCC2=CC=CC=C2)(C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C30H41FO8S/c1-36-28(32)15-9-4-5-10-20-30(29(33)37-2,40(3,34)35)21-11-14-27(38-22-24-12-7-6-8-13-24)23-39-26-18-16-25(31)17-19-26/h6-8,12-13,16-19,27H,4-5,9-11,14-15,20-23H2,1-3H3