aluminum [4-[(Z)-dec-2-en-3-yl]-2,3,5,6-tetrakis[(E)-dec-2-en-3-yl]phenyl] ethyl phosphate

Systemtic Name: aluminum [4-[(Z)-dec-2-en-3-yl]-2,3,5,6-tetrakis[(E)-dec-2-en-3-yl]phenyl] ethyl phosphate Openeye Name: aluminum ethyl [4-[(1Z)-1-ethylideneoctyl]-2,3,5,6-tetrakis[(1E)-1-ethylideneoctyl]phenyl] phosphate CAS Name: aluminum [4-[(Z)-dec-2-en-3-yl]-2,3,5,6-tetrakis[(E)-dec-2-en-3-yl]phenyl] ethyl phosphate IUPAC Name: aluminum [4-[(Z)-dec-2-en-3-yl]-2,3,5,6-tetrakis[(E)-dec-2-en-3-yl]phenyl] ethyl phosphate Traditional Name: aluminum ethyl [4-[(Z)-1-heptylprop-1-enyl]-2,3,5,6-tetrakis[(E)-1-heptylprop-1-enyl]phenyl] phosphate Formula: C58H100AlO4P+2 MolecularWeight: 919.367499

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=CC)C1=C(C(=C(C(=C1C(=CC)CCCCCCC)C(=CC)CCCCCCC)OP(=O)([O-])OCC)C(=CC)CCCCCCC)C(=CC)CCCCCCC.[Al+3]

Isomeric SMILES

CCCCCCC/C(=C/C)/C1=C(C(=C(C(=C1/C(=C/C)/CCCCCCC)/C(=C/C)/CCCCCCC)OP(=O)([O-])OCC)/C(=C/C)/CCCCCCC)/C(=C/C)/CCCCCCC.[Al+3]

InChI

InChI=1S/C58H101O4P.Al/c1-12-23-28-33-38-43-48(17-6)53-54(49(18-7)44-39-34-29-24-13-2)56(51(20-9)46-41-36-31-26-15-4)58(62-63(59,60)61-22-11)57(52(21-10)47-42-37-32-27-16-5)55(53)50(19-8)45-40-35-30-25-14-3;/h17-21H,12-16,22-47H2,1-11H3,(H,59,60);/q;+3/p-1/b48-17-,49-18+,50-19+,51-20+,52-21+;