sodium 3-(2-dicyclohexylphosphanylphenyl)-2,4-di(propan-2-yl)benzenesulfonate

Systemtic Name: sodium 3-(2-dicyclohexylphosphanylphenyl)-2,4-di(propan-2-yl)benzenesulfonate Openeye Name: sodium 3-(2-dicyclohexylphosphanylphenyl)-2,4-diisopropyl-benzenesulfonate CAS Name: sodium 3-(2-dicyclohexylphosphinophenyl)-2,4-di(propan-2-yl)benzenesulfonate IUPAC Name: sodium 3-(2-dicyclohexylphosphanylphenyl)-2,4-di(propan-2-yl)benzenesulfonate Traditional Name: sodium 3-(2-dicyclohexylphosphinophenyl)-2,4-diisopropyl-besylate Formula: C30H42NaO3PS MolecularWeight: 536.681211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)S(=O)(=O)[O-])C(C)C)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4.[Na+]

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)S(=O)(=O)[O-])C(C)C)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4.[Na+]

InChI

InChI=1S/C30H43O3PS.Na/c1-21(2)25-19-20-28(35(31,32)33)29(22(3)4)30(25)26-17-11-12-18-27(26)34(23-13-7-5-8-14-23)24-15-9-6-10-16-24;/h11-12,17-24H,5-10,13-16H2,1-4H3,(H,31,32,33);/q;+1/p-1