10-[5-(2,8-dimethylphenoxaphosphinin-10-yl)-2,7-dihexyl-9,9-dimethyl-xanthen-4-yl]-2,8-dimethyl-phenoxaphosphinine

Systemtic Name: 10-[5-(2,8-dimethylphenoxaphosphinin-10-yl)-2,7-dihexyl-9,9-dimethyl-xanthen-4-yl]-2,8-dimethyl-phenoxaphosphinine Openeye Name: 10-[5-(2,8-dimethylphenoxaphosphinin-10-yl)-2,7-dihexyl-9,9-dimethyl-xanthen-4-yl]-2,8-dimethyl-phenoxaphosphinine CAS Name: 10-[5-(2,8-dimethyl-10-phenoxaphosphininyl)-2,7-dihexyl-9,9-dimethyl-4-xanthenyl]-2,8-dimethylphenoxaphosphinine IUPAC Name: 10-[5-(2,8-dimethylphenoxaphosphinin-10-yl)-2,7-dihexyl-9,9-dimethylxanthen-4-yl]-2,8-dimethylphenoxaphosphinine Traditional Name: 10-[5-(2,8-dimethylphenoxaphosphinin-10-yl)-2,7-dihexyl-9,9-dimethyl-xanthen-4-yl]-2,8-dimethyl-phenoxaphosphinine Formula: C55H60O3P2 MolecularWeight: 831.010622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C2C(=C1)C(C3=CC(=CC(=C3O2)P4C5=C(C=CC(=C5)C)OC6=C4C=C(C=C6)C)CCCCCC)(C)C)P7C8=C(C=CC(=C8)C)OC9=C7C=C(C=C9)C

Isomeric SMILES

CCCCCCC1=CC(=C2C(=C1)C(C3=CC(=CC(=C3O2)P4C5=C(C=CC(=C5)C)OC6=C4C=C(C=C6)C)CCCCCC)(C)C)P7C8=C(C=CC(=C8)C)OC9=C7C=C(C=C9)C

InChI

InChI=1S/C55H60O3P2/c1-9-11-13-15-17-39-31-41-53(51(33-39)59-47-27-35(3)19-23-43(47)56-44-24-20-36(4)28-48(44)59)58-54-42(55(41,7)8)32-40(18-16-14-12-10-2)34-52(54)60-49-29-37(5)21-25-45(49)57-46-26-22-38(6)30-50(46)60/h19-34H,9-18H2,1-8H3