(4-ethoxyphenyl) 4-[4-[(2R)-octan-2-yl]oxyphenyl]benzoate

Systemtic Name: (4-ethoxyphenyl) 4-[4-[(2R)-octan-2-yl]oxyphenyl]benzoate Openeye Name: (4-ethoxyphenyl) 4-[4-[(1R)-1-methylheptoxy]phenyl]benzoate CAS Name: 4-[4-[(2R)-octan-2-yl]oxyphenyl]benzoic acid (4-ethoxyphenyl) ester IUPAC Name: (4-ethoxyphenyl) 4-[4-[(2R)-octan-2-yl]oxyphenyl]benzoate Traditional Name: 4-[4-[(1R)-1-methylheptoxy]phenyl]benzoic acid p-phenetyl ester Formula: C29H34O4 MolecularWeight: 446.57786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCC[C@@H](C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC

InChI

InChI=1S/C29H34O4/c1-4-6-7-8-9-22(3)32-27-16-14-24(15-17-27)23-10-12-25(13-11-23)29(30)33-28-20-18-26(19-21-28)31-5-2/h10-22H,4-9H2,1-3H3/t22-/m1/s1