dimethyl 2-[5-[2,4-bis(chloranyl)phenoxy]-4-phenylmethoxy-pentyl]-2-methylsulfonyl-nonanedioate

Systemtic Name: dimethyl 2-[5-[2,4-bis(chloranyl)phenoxy]-4-phenylmethoxy-pentyl]-2-methylsulfonyl-nonanedioate Openeye Name: dimethyl 2-[4-benzyloxy-5-(2,4-dichlorophenoxy)pentyl]-2-methylsulfonyl-nonanedioate CAS Name: 2-[5-(2,4-dichlorophenoxy)-4-phenylmethoxypentyl]-2-methylsulfonylnonanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[5-(2,4-dichlorophenoxy)-4-phenylmethoxypentyl]-2-methylsulfonylnonanedioate Traditional Name: 2-[4-benzoxy-5-(2,4-dichlorophenoxy)pentyl]-2-mesyl-azelaic acid dimethyl ester Formula: C30H40Cl2O8S MolecularWeight: 631.6048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H40Cl2O8S/c1-37-28(33)15-9-4-5-10-18-30(29(34)38-2,41(3,35)36)19-11-14-25(39-21-23-12-7-6-8-13-23)22-40-27-17-16-24(31)20-26(27)32/h6-8,12-13,16-17,20,25H,4-5,9-11,14-15,18-19,21-22H2,1-3H3