1-butoxyethyl 4-(4-heptylphenyl)benzoate

Systemtic Name: 1-butoxyethyl 4-(4-heptylphenyl)benzoate Openeye Name: 1-butoxyethyl 4-(4-heptylphenyl)benzoate CAS Name: 4-(4-heptylphenyl)benzoic acid 1-butoxyethyl ester IUPAC Name: 1-butoxyethyl 4-(4-heptylphenyl)benzoate Traditional Name: 4-(4-heptylphenyl)benzoic acid 1-butoxyethyl ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)OCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)OCCCC

InChI

InChI=1S/C26H36O3/c1-4-6-8-9-10-11-22-12-14-23(15-13-22)24-16-18-25(19-17-24)26(27)29-21(3)28-20-7-5-2/h12-19,21H,4-11,20H2,1-3H3