(5-butoxy-2-tridecanoyl-phenyl) ethanoate

Systemtic Name: (5-butoxy-2-tridecanoyl-phenyl) ethanoate Openeye Name: (5-butoxy-2-tridecanoyl-phenyl) acetate CAS Name: acetic acid [5-butoxy-2-(1-oxotridecyl)phenyl] ester IUPAC Name: (5-butoxy-2-tridecanoylphenyl) acetate Traditional Name: acetic acid (5-butoxy-2-tridecanoyl-phenyl) ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)C1=C(C=C(C=C1)OCCCC)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCC(=O)C1=C(C=C(C=C1)OCCCC)OC(=O)C

InChI

InChI=1S/C25H40O4/c1-4-6-8-9-10-11-12-13-14-15-16-24(27)23-18-17-22(28-19-7-5-2)20-25(23)29-21(3)26/h17-18,20H,4-16,19H2,1-3H3