ethyl 2-[4-[1-cyano-6-(2-ethanoyl-5-phenylmethoxy-phenoxy)hexyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[1-cyano-6-(2-ethanoyl-5-phenylmethoxy-phenoxy)hexyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[6-(2-acetyl-5-benzyloxy-phenoxy)-1-cyano-hexyl]phenoxy]acetate CAS Name: 2-[4-[6-(2-acetyl-5-phenylmethoxyphenoxy)-1-cyanohexyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[6-(2-acetyl-5-phenylmethoxyphenoxy)-1-cyanohexyl]phenoxy]acetate Traditional Name: 2-[4-[6-(2-acetyl-5-benzoxy-phenoxy)-1-cyano-hexyl]phenoxy]acetic acid ethyl ester Formula: C32H35NO6 MolecularWeight: 529.6234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C(CCCCCOC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=O)C)C#N

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)C(CCCCCOC2=C(C=CC(=C2)OCC3=CC=CC=C3)C(=O)C)C#N

InChI

InChI=1S/C32H35NO6/c1-3-36-32(35)23-39-28-15-13-26(14-16-28)27(21-33)12-8-5-9-19-37-31-20-29(17-18-30(31)24(2)34)38-22-25-10-6-4-7-11-25/h4,6-7,10-11,13-18,20,27H,3,5,8-9,12,19,22-23H2,1-2H3