[4-(1-butoxyethyl)phenyl] 4-(4-dodecylphenyl)benzoate

Systemtic Name: [4-(1-butoxyethyl)phenyl] 4-(4-dodecylphenyl)benzoate Openeye Name: [4-(1-butoxyethyl)phenyl] 4-(4-dodecylphenyl)benzoate CAS Name: 4-(4-dodecylphenyl)benzoic acid [4-(1-butoxyethyl)phenyl] ester IUPAC Name: [4-(1-butoxyethyl)phenyl] 4-(4-dodecylphenyl)benzoate Traditional Name: 4-(4-laurylphenyl)benzoic acid [4-(1-butoxyethyl)phenyl] ester Formula: C37H50O3 MolecularWeight: 542.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(C)OCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(C)OCCCC

InChI

InChI=1S/C37H50O3/c1-4-6-8-9-10-11-12-13-14-15-16-31-17-19-33(20-18-31)34-21-23-35(24-22-34)37(38)40-36-27-25-32(26-28-36)30(3)39-29-7-5-2/h17-28,30H,4-16,29H2,1-3H3