[4-(4-octoxyphenyl)phenyl] 4-(1-heptoxyethyl)benzoate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 4-(1-heptoxyethyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 4-(1-heptoxyethyl)benzoate CAS Name: 4-(1-heptoxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 4-(1-heptoxyethyl)benzoate Traditional Name: 4-(1-heptoxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C36H48O4 MolecularWeight: 544.76392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCC

InChI

InChI=1S/C36H48O4/c1-4-6-8-10-12-14-28-39-34-23-19-31(20-24-34)32-21-25-35(26-22-32)40-36(37)33-17-15-30(16-18-33)29(3)38-27-13-11-9-7-5-2/h15-26,29H,4-14,27-28H2,1-3H3