dimethyl 2-methylsulfonyl-2-(5-phenoxy-4-phenylmethoxy-pentyl)nonanedioate

Systemtic Name: dimethyl 2-methylsulfonyl-2-(5-phenoxy-4-phenylmethoxy-pentyl)nonanedioate Openeye Name: dimethyl 2-(4-benzyloxy-5-phenoxy-pentyl)-2-methylsulfonyl-nonanedioate CAS Name: 2-methylsulfonyl-2-(5-phenoxy-4-phenylmethoxypentyl)nonanedioic acid dimethyl ester IUPAC Name: dimethyl 2-methylsulfonyl-2-(5-phenoxy-4-phenylmethoxypentyl)nonanedioate Traditional Name: 2-(4-benzoxy-5-phenoxy-pentyl)-2-mesyl-azelaic acid dimethyl ester Formula: C30H42O8S MolecularWeight: 562.71468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H42O8S/c1-35-28(31)20-12-4-5-13-21-30(29(32)36-2,39(3,33)34)22-14-19-27(24-38-26-17-10-7-11-18-26)37-23-25-15-8-6-9-16-25/h6-11,15-18,27H,4-5,12-14,19-24H2,1-3H3