(4-nonoxyphenyl) 4-[4-[(2S)-2-methylbutoxy]carbonyloxyphenyl]benzoate

Systemtic Name: (4-nonoxyphenyl) 4-[4-[(2S)-2-methylbutoxy]carbonyloxyphenyl]benzoate Openeye Name: (4-nonoxyphenyl) 4-[4-[(2S)-2-methylbutoxy]carbonyloxyphenyl]benzoate CAS Name: 4-[4-[[(2S)-2-methylbutoxy]-oxomethoxy]phenyl]benzoic acid (4-nonoxyphenyl) ester IUPAC Name: (4-nonoxyphenyl) 4-[4-[(2S)-2-methylbutoxy]carbonyloxyphenyl]benzoate Traditional Name: 4-[4-[(2S)-2-methylbutoxy]carbonyloxyphenyl]benzoic acid (4-nonoxyphenyl) ester Formula: C34H42O6 MolecularWeight: 546.69368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)OC[C@@H](C)CC

InChI

InChI=1S/C34H42O6/c1-4-6-7-8-9-10-11-24-37-30-20-22-31(23-21-30)39-33(35)29-14-12-27(13-15-29)28-16-18-32(19-17-28)40-34(36)38-25-26(3)5-2/h12-23,26H,4-11,24-25H2,1-3H3/t26-/m0/s1