6-(4-octanoylphenyl)hexyl 2-acetamidopropanoate

Systemtic Name: 6-(4-octanoylphenyl)hexyl 2-acetamidopropanoate Openeye Name: 6-(4-octanoylphenyl)hexyl 2-acetamidopropanoate CAS Name: 2-acetamidopropanoic acid 6-[4-(1-oxooctyl)phenyl]hexyl ester IUPAC Name: 6-(4-octanoylphenyl)hexyl 2-acetamidopropanoate Traditional Name: 2-acetamidopropionic acid 6-(4-caprylylphenyl)hexyl ester Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC=C(C=C1)CCCCCCOC(=O)C(C)NC(=O)C

Isomeric SMILES

CCCCCCCC(=O)C1=CC=C(C=C1)CCCCCCOC(=O)C(C)NC(=O)C

InChI

InChI=1S/C25H39NO4/c1-4-5-6-7-11-14-24(28)23-17-15-22(16-18-23)13-10-8-9-12-19-30-25(29)20(2)26-21(3)27/h15-18,20H,4-14,19H2,1-3H3,(H,26,27)