octan-2-yl 4-(4-pentylphenyl)benzoate

Systemtic Name: octan-2-yl 4-(4-pentylphenyl)benzoate Openeye Name: 1-methylheptyl 4-(4-pentylphenyl)benzoate CAS Name: 4-(4-pentylphenyl)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(4-pentylphenyl)benzoate Traditional Name: 4-(4-amylphenyl)benzoic acid 1-methylheptyl ester Formula: C26H36O2 MolecularWeight: 380.56284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C26H36O2/c1-4-6-8-10-11-21(3)28-26(27)25-19-17-24(18-20-25)23-15-13-22(14-16-23)12-9-7-5-2/h13-21H,4-12H2,1-3H3