bis(2,6-ditert-butyl-4-dodecoxycarbonyl-phenoxy)-oxidanylidene-phosphanium

Systemtic Name: bis(2,6-ditert-butyl-4-dodecoxycarbonyl-phenoxy)-oxidanylidene-phosphanium Openeye Name: bis(2,6-ditert-butyl-4-dodecoxycarbonyl-phenoxy)-oxo-phosphonium CAS Name: bis[2,6-ditert-butyl-4-[dodecoxy(oxo)methyl]phenoxy]-oxophosphonium IUPAC Name: bis(2,6-ditert-butyl-4-dodecoxycarbonylphenoxy)-oxophosphanium Traditional Name: bis(2,6-ditert-butyl-4-lauryloxycarbonyl-phenoxy)-keto-phosphonium Formula: C54H90O7P+ MolecularWeight: 882.261961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O[P+](=O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)OCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O[P+](=O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)OCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C54H90O7P/c1-15-17-19-21-23-25-27-29-31-33-35-58-49(55)41-37-43(51(3,4)5)47(44(38-41)52(6,7)8)60-62(57)61-48-45(53(9,10)11)39-42(40-46(48)54(12,13)14)50(56)59-36-34-32-30-28-26-24-22-20-18-16-2/h37-40H,15-36H2,1-14H3/q+1