(2-butylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate

Systemtic Name: (2-butylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Openeye Name: (2-butylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid (2-butylphenyl) ester IUPAC Name: (2-butylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-lauryloxyethyl)phenyl]benzoic acid (2-butylphenyl) ester Formula: C37H50O3 MolecularWeight: 542.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCC

InChI

InChI=1S/C37H50O3/c1-4-6-8-9-10-11-12-13-14-17-29-39-30(3)31-21-23-32(24-22-31)33-25-27-35(28-26-33)37(38)40-36-20-16-15-19-34(36)18-7-5-2/h15-16,19-28,30H,4-14,17-18,29H2,1-3H3