[4-(4-nonylphenyl)phenyl] 4-(1-hexoxyethyl)benzoate

Systemtic Name: [4-(4-nonylphenyl)phenyl] 4-(1-hexoxyethyl)benzoate Openeye Name: [4-(4-nonylphenyl)phenyl] 4-(1-hexoxyethyl)benzoate CAS Name: 4-(1-hexoxyethyl)benzoic acid [4-(4-nonylphenyl)phenyl] ester IUPAC Name: [4-(4-nonylphenyl)phenyl] 4-(1-hexoxyethyl)benzoate Traditional Name: 4-(1-hexoxyethyl)benzoic acid [4-(4-nonylphenyl)phenyl] ester Formula: C36H48O3 MolecularWeight: 528.76452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCC

InChI

InChI=1S/C36H48O3/c1-4-6-8-10-11-12-13-15-30-16-18-32(19-17-30)33-24-26-35(27-25-33)39-36(37)34-22-20-31(21-23-34)29(3)38-28-14-9-7-5-2/h16-27,29H,4-15,28H2,1-3H3