2-[butanoyl(ethyl)amino]oxycarbonyl-2-(4-octanoylphenyl)butanoate

Systemtic Name: 2-[butanoyl(ethyl)amino]oxycarbonyl-2-(4-octanoylphenyl)butanoate Openeye Name: 2-[butanoyl(ethyl)amino]oxycarbonyl-2-(4-octanoylphenyl)butanoate CAS Name: 2-[[ethyl(1-oxobutyl)amino]oxy-oxomethyl]-2-[4-(1-oxooctyl)phenyl]butanoate IUPAC Name: 2-[butanoyl(ethyl)amino]oxycarbonyl-2-(4-octanoylphenyl)butanoate Traditional Name: 2-[butyryl(ethyl)amino]oxycarbonyl-2-(4-caprylylphenyl)butyrate Formula: C25H36NO6- MolecularWeight: 446.55644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC=C(C=C1)C(CC)(C(=O)[O-])C(=O)ON(CC)C(=O)CCC

Isomeric SMILES

CCCCCCCC(=O)C1=CC=C(C=C1)C(CC)(C(=O)[O-])C(=O)ON(CC)C(=O)CCC

InChI

InChI=1S/C25H37NO6/c1-5-9-10-11-12-14-21(27)19-15-17-20(18-16-19)25(7-3,23(29)30)24(31)32-26(8-4)22(28)13-6-2/h15-18H,5-14H2,1-4H3,(H,29,30)/p-1