2-chloroethyl(triphenyl)phosphanium; 3,5-ditert-butyl-4-oxidanyl-benzenesulfonate

Systemtic Name: 2-chloroethyl(triphenyl)phosphanium; 3,5-ditert-butyl-4-oxidanyl-benzenesulfonate Openeye Name: 2-chloroethyl(triphenyl)phosphonium; 3,5-ditert-butyl-4-hydroxy-benzenesulfonate CAS Name: 2-chloroethyl(triphenyl)phosphonium; 3,5-ditert-butyl-4-hydroxybenzenesulfonate IUPAC Name: 2-chloroethyl(triphenyl)phosphanium; 3,5-ditert-butyl-4-hydroxybenzenesulfonate Traditional Name: 2-chloroethyl(triphenyl)phosphonium; 3,5-ditert-butyl-4-hydroxy-besylate Formula: C34H40ClO4PS MolecularWeight: 611.170761

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)S(=O)(=O)[O-].C1=CC=C(C=C1)[P+](CCCl)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)S(=O)(=O)[O-].C1=CC=C(C=C1)[P+](CCCl)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H19ClP.C14H22O4S/c21-16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;1-13(2,3)10-7-9(19(16,17)18)8-11(12(10)15)14(4,5)6/h1-15H,16-17H2;7-8,15H,1-6H3,(H,16,17,18)/q+1;/p-1