ethyl 2-[[5-(hexanoylamino)-2-octoxy-phenyl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[5-(hexanoylamino)-2-octoxy-phenyl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[5-(hexanoylamino)-2-octoxy-benzoyl]amino]acetate CAS Name: 2-[[[2-octoxy-5-(1-oxohexylamino)phenyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(hexanoylamino)-2-octoxybenzoyl]amino]acetate Traditional Name: 2-[[5-(caproylamino)-2-octoxy-benzoyl]amino]acetic acid ethyl ester Formula: C25H40N2O5 MolecularWeight: 448.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)NC(=O)CCCCC)C(=O)NCC(=O)OCC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)NC(=O)CCCCC)C(=O)NCC(=O)OCC

InChI

InChI=1S/C25H40N2O5/c1-4-7-9-10-11-13-17-32-22-16-15-20(27-23(28)14-12-8-5-2)18-21(22)25(30)26-19-24(29)31-6-3/h15-16,18H,4-14,17,19H2,1-3H3,(H,26,30)(H,27,28)