(2-butylphenyl) 4-(1-octoxyethyl)benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2CCCC

Isomeric SMILES

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2CCCC

InChI

InChI=1S/C27H38O3/c1-4-6-8-9-10-13-21-29-22(3)23-17-19-25(20-18-23)27(28)30-26-16-12-11-15-24(26)14-7-5-2/h11-12,15-20,22H,4-10,13-14,21H2,1-3H3