(4-cyanophenyl) 2-(4-octoxyphenyl)carbonyloxybenzoate

Systemtic Name: (4-cyanophenyl) 2-(4-octoxyphenyl)carbonyloxybenzoate Openeye Name: (4-cyanophenyl) 2-(4-octoxybenzoyl)oxybenzoate CAS Name: 2-[(4-octoxyphenyl)-oxomethoxy]benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2-(4-octoxybenzoyl)oxybenzoate Traditional Name: 2-(4-octoxybenzoyl)oxybenzoic acid (4-cyanophenyl) ester Formula: C29H29NO5 MolecularWeight: 471.54426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C29H29NO5/c1-2-3-4-5-6-9-20-33-24-18-14-23(15-19-24)28(31)35-27-11-8-7-10-26(27)29(32)34-25-16-12-22(21-30)13-17-25/h7-8,10-19H,2-6,9,20H2,1H3