3-bis(4-tert-butylphenyl)phosphanylbenzenesulfonic acid

Systemtic Name: 3-bis(4-tert-butylphenyl)phosphanylbenzenesulfonic acid Openeye Name: 3-bis(4-tert-butylphenyl)phosphanylbenzenesulfonic acid CAS Name: 3-bis(4-tert-butylphenyl)phosphinobenzenesulfonic acid IUPAC Name: 3-bis(4-tert-butylphenyl)phosphanylbenzenesulfonic acid Traditional Name: 3-bis(4-tert-butylphenyl)phosphinobesylic acid Formula: C26H31O3PS MolecularWeight: 454.561301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)C(C)(C)C)C3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)C(C)(C)C)C3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C26H31O3PS/c1-25(2,3)19-10-14-21(15-11-19)30(22-16-12-20(13-17-22)26(4,5)6)23-8-7-9-24(18-23)31(27,28)29/h7-18H,1-6H3,(H,27,28,29)