phosphanyl 3-diphenylphosphanyl-4-pentan-2-yl-2-phenyl-benzenesulfonate

Systemtic Name: phosphanyl 3-diphenylphosphanyl-4-pentan-2-yl-2-phenyl-benzenesulfonate Openeye Name: phosphanyl 3-diphenylphosphanyl-4-(1-methylbutyl)-2-phenyl-benzenesulfonate CAS Name: 3-diphenylphosphino-4-pentan-2-yl-2-phenylbenzenesulfonic acid phosphino ester IUPAC Name: phosphanyl 3-diphenylphosphanyl-4-pentan-2-yl-2-phenylbenzenesulfonate Traditional Name: 3-diphenylphosphino-4-(1-methylbutyl)-2-phenyl-benzenesulfonic acid phosphino ester Formula: C29H30O3P2S MolecularWeight: 520.559222

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=C(C(=C(C=C1)S(=O)(=O)OP)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC(C)C1=C(C(=C(C=C1)S(=O)(=O)OP)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H30O3P2S/c1-3-13-22(2)26-20-21-27(35(30,31)32-33)28(23-14-7-4-8-15-23)29(26)34(24-16-9-5-10-17-24)25-18-11-6-12-19-25/h4-12,14-22H,3,13,33H2,1-2H3