[3-acetamido-3-ethyl-5-(4-octanoylphenyl)pentyl] ethanoate

Systemtic Name: [3-acetamido-3-ethyl-5-(4-octanoylphenyl)pentyl] ethanoate Openeye Name: [3-acetamido-3-ethyl-5-(4-octanoylphenyl)pentyl] acetate CAS Name: acetic acid [3-acetamido-3-ethyl-5-[4-(1-oxooctyl)phenyl]pentyl] ester IUPAC Name: [3-acetamido-3-ethyl-5-(4-octanoylphenyl)pentyl] acetate Traditional Name: acetic acid [3-acetamido-5-(4-caprylylphenyl)-3-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(CC)(CCOC(=O)C)NC(=O)C

Isomeric SMILES

CCCCCCCC(=O)C1=CC=C(C=C1)CCC(CC)(CCOC(=O)C)NC(=O)C

InChI

InChI=1S/C25H39NO4/c1-5-7-8-9-10-11-24(29)23-14-12-22(13-15-23)16-17-25(6-2,26-20(3)27)18-19-30-21(4)28/h12-15H,5-11,16-19H2,1-4H3,(H,26,27)