(4-methoxyphenyl) 7-[tris(4-octylphenoxy)methyl]naphthalene-2-carboxylate

Systemtic Name: (4-methoxyphenyl) 7-[tris(4-octylphenoxy)methyl]naphthalene-2-carboxylate Openeye Name: (4-methoxyphenyl) 7-[tris(4-octylphenoxy)methyl]naphthalene-2-carboxylate CAS Name: 7-[tris(4-octylphenoxy)methyl]-2-naphthalenecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 7-[tris(4-octylphenoxy)methyl]naphthalene-2-carboxylate Traditional Name: 7-[tris(4-octylphenoxy)methyl]naphthalene-2-carboxylic acid (4-methoxyphenyl) ester Formula: C61H76O6 MolecularWeight: 905.25254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OC(C2=CC3=C(C=CC(=C3)C(=O)OC4=CC=C(C=C4)OC)C=C2)(OC5=CC=C(C=C5)CCCCCCCC)OC6=CC=C(C=C6)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OC(C2=CC3=C(C=CC(=C3)C(=O)OC4=CC=C(C=C4)OC)C=C2)(OC5=CC=C(C=C5)CCCCCCCC)OC6=CC=C(C=C6)CCCCCCCC

InChI

InChI=1S/C61H76O6/c1-5-8-11-14-17-20-23-48-26-36-57(37-27-48)65-61(66-58-38-28-49(29-39-58)24-21-18-15-12-9-6-2,67-59-40-30-50(31-41-59)25-22-19-16-13-10-7-3)54-35-34-51-32-33-52(46-53(51)47-54)60(62)64-56-44-42-55(63-4)43-45-56/h26-47H,5-25H2,1-4H3