(2-octylphenyl) 4-(1-butoxyethyl)benzoate

Systemtic Name: (2-octylphenyl) 4-(1-butoxyethyl)benzoate Openeye Name: (2-octylphenyl) 4-(1-butoxyethyl)benzoate CAS Name: 4-(1-butoxyethyl)benzoic acid (2-octylphenyl) ester IUPAC Name: (2-octylphenyl) 4-(1-butoxyethyl)benzoate Traditional Name: 4-(1-butoxyethyl)benzoic acid (2-octylphenyl) ester Formula: C27H38O3 MolecularWeight: 410.58882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCC

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCC

InChI

InChI=1S/C27H38O3/c1-4-6-8-9-10-11-14-24-15-12-13-16-26(24)30-27(28)25-19-17-23(18-20-25)22(3)29-21-7-5-2/h12-13,15-20,22H,4-11,14,21H2,1-3H3