2-[2-(4-octanoylphenyl)ethyl]pentyl 2-acetamidoethanoate

Systemtic Name: 2-[2-(4-octanoylphenyl)ethyl]pentyl 2-acetamidoethanoate Openeye Name: 2-[2-(4-octanoylphenyl)ethyl]pentyl 2-acetamidoacetate CAS Name: 2-acetamidoacetic acid 2-[2-[4-(1-oxooctyl)phenyl]ethyl]pentyl ester IUPAC Name: 2-[2-(4-octanoylphenyl)ethyl]pentyl 2-acetamidoacetate Traditional Name: 2-acetamidoacetic acid 2-[2-(4-caprylylphenyl)ethyl]pentyl ester Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC=C(C=C1)CCC(CCC)COC(=O)CNC(=O)C

Isomeric SMILES

CCCCCCCC(=O)C1=CC=C(C=C1)CCC(CCC)COC(=O)CNC(=O)C

InChI

InChI=1S/C25H39NO4/c1-4-6-7-8-9-11-24(28)23-16-14-21(15-17-23)12-13-22(10-5-2)19-30-25(29)18-26-20(3)27/h14-17,22H,4-13,18-19H2,1-3H3,(H,26,27)