[4-(1-nonadecoxyethyl)phenyl] 4-(4-hexylphenyl)benzoate

Systemtic Name: [4-(1-nonadecoxyethyl)phenyl] 4-(4-hexylphenyl)benzoate Openeye Name: [4-(1-nonadecoxyethyl)phenyl] 4-(4-hexylphenyl)benzoate CAS Name: 4-(4-hexylphenyl)benzoic acid [4-(1-nonadecoxyethyl)phenyl] ester IUPAC Name: [4-(1-nonadecoxyethyl)phenyl] 4-(4-hexylphenyl)benzoate Traditional Name: 4-(4-hexylphenyl)benzoic acid [4-(1-nonadecoxyethyl)phenyl] ester Formula: C46H68O3 MolecularWeight: 669.03032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C46H68O3/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-24-38-48-39(3)41-34-36-45(37-35-41)49-46(47)44-32-30-43(31-33-44)42-28-26-40(27-29-42)25-23-9-7-5-2/h26-37,39H,4-25,38H2,1-3H3