trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenyl-methoxy]oct-1-enyl]alumanuide

Systemtic Name: trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenyl-methoxy]oct-1-enyl]alumanuide Openeye Name: trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenyl-methoxy]oct-1-enyl]alumanuide CAS Name: trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenylmethoxy]oct-1-enyl]alumanuide IUPAC Name: trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenylmethoxy]oct-1-enyl]alumanuide Traditional Name: trihexyl-[(E)-3-[(4-methoxyphenyl)-diphenyl-methoxy]oct-1-enyl]alumanuide Formula: C46H70AlO2- MolecularWeight: 682.028338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[Al-](CCCCCC)(CCCCCC)C=CC(CCCCC)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCC[Al-](CCCCCC)(CCCCCC)/C=C/C(CCCCC)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H31O2.3C6H13.Al/c1-4-6-9-18-26(5-2)30-28(23-14-10-7-11-15-23,24-16-12-8-13-17-24)25-19-21-27(29-3)22-20-25;3*1-3-5-6-4-2;/h2,5,7-8,10-17,19-22,26H,4,6,9,18H2,1,3H3;3*1,3-6H2,2H3;/q;;;;-1