(2,3-diethoxy-5,6-dioctyl-4-phenyl-phenyl)-diethoxy-methanesulfonic acid

Systemtic Name: (2,3-diethoxy-5,6-dioctyl-4-phenyl-phenyl)-diethoxy-methanesulfonic acid Openeye Name: (2,3-diethoxy-5,6-dioctyl-4-phenyl-phenyl)-diethoxy-methanesulfonic acid CAS Name: (2,3-diethoxy-5,6-dioctyl-4-phenylphenyl)-diethoxymethanesulfonic acid IUPAC Name: (2,3-diethoxy-5,6-dioctyl-4-phenylphenyl)-diethoxymethanesulfonic acid Traditional Name: (2,3-diethoxy-5,6-dioctyl-4-phenyl-phenyl)-diethoxy-methanesulfonic acid Formula: C37H60O7S MolecularWeight: 648.9331

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C(=C1CCCCCCCC)C(OCC)(OCC)S(=O)(=O)O)OCC)OCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C(=C1CCCCCCCC)C(OCC)(OCC)S(=O)(=O)O)OCC)OCC)C2=CC=CC=C2

InChI

InChI=1S/C37H60O7S/c1-7-13-15-17-19-24-28-31-32(29-25-20-18-16-14-8-2)34(37(43-11-5,44-12-6)45(38,39)40)36(42-10-4)35(41-9-3)33(31)30-26-22-21-23-27-30/h21-23,26-27H,7-20,24-25,28-29H2,1-6H3,(H,38,39,40)