[2-(1-pentoxypentoxy)phenyl] 4-octoxybenzoate

Systemtic Name: [2-(1-pentoxypentoxy)phenyl] 4-octoxybenzoate Openeye Name: [2-(1-pentoxypentoxy)phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [2-(1-pentoxypentoxy)phenyl] ester IUPAC Name: [2-(1-pentoxypentoxy)phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [2-(1-amoxypentoxy)phenyl] ester Formula: C31H46O5 MolecularWeight: 498.69394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2OC(CCCC)OCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2OC(CCCC)OCCCCC

InChI

InChI=1S/C31H46O5/c1-4-7-10-11-12-16-24-33-27-22-20-26(21-23-27)31(32)36-29-18-14-13-17-28(29)35-30(19-9-6-3)34-25-15-8-5-2/h13-14,17-18,20-23,30H,4-12,15-16,19,24-25H2,1-3H3