[2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate

Systemtic Name: [2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate Openeye Name: [2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate CAS Name: [2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate IUPAC Name: [2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate Traditional Name: [2,3-di(nonyl)-4,5-bis(2-nonylphenyl)phenyl] dihydrogen phosphate Formula: C54H87O4P MolecularWeight: 831.239941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1C2=CC(=C(C(=C2C3=CC=CC=C3CCCCCCCCC)CCCCCCCCC)CCCCCCCCC)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1C2=CC(=C(C(=C2C3=CC=CC=C3CCCCCCCCC)CCCCCCCCC)CCCCCCCCC)OP(=O)(O)O

InChI

InChI=1S/C54H87O4P/c1-5-9-13-17-21-25-29-37-46-39-33-35-41-48(46)52-45-53(58-59(55,56)57)50(43-31-27-23-19-15-11-7-3)51(44-32-28-24-20-16-12-8-4)54(52)49-42-36-34-40-47(49)38-30-26-22-18-14-10-6-2/h33-36,39-42,45H,5-32,37-38,43-44H2,1-4H3,(H2,55,56,57)