lithium 5-methoxy-2-[4-[4-(4-methylphenyl)carbonylphenoxy]phenyl]carbonyl-benzenesulfonate

Systemtic Name: lithium 5-methoxy-2-[4-[4-(4-methylphenyl)carbonylphenoxy]phenyl]carbonyl-benzenesulfonate Openeye Name: lithium 5-methoxy-2-[4-[4-(4-methylbenzoyl)phenoxy]benzoyl]benzenesulfonate CAS Name: lithium 5-methoxy-2-[[4-[4-[(4-methylphenyl)-oxomethyl]phenoxy]phenyl]-oxomethyl]benzenesulfonate IUPAC Name: lithium 5-methoxy-2-[4-[4-(4-methylbenzoyl)phenoxy]benzoyl]benzenesulfonate Traditional Name: lithium 5-methoxy-2-[4-(4-p-toluoylphenoxy)benzoyl]besylate Formula: C28H21LiO7S MolecularWeight: 508.46814

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)C4=C(C=C(C=C4)OC)S(=O)(=O)[O-]

Isomeric SMILES

[Li+].CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)C4=C(C=C(C=C4)OC)S(=O)(=O)[O-]

InChI

InChI=1S/C28H22O7S.Li/c1-18-3-5-19(6-4-18)27(29)20-7-11-22(12-8-20)35-23-13-9-21(10-14-23)28(30)25-16-15-24(34-2)17-26(25)36(31,32)33;/h3-17H,1-2H3,(H,31,32,33);/q;+1/p-1