ethyl 4-(hexylamino)-2-[methyl(2-octoxyethanoyl)amino]benzoate

Systemtic Name: ethyl 4-(hexylamino)-2-[methyl(2-octoxyethanoyl)amino]benzoate Openeye Name: ethyl 4-(hexylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoate CAS Name: 4-(hexylamino)-2-[methyl-(2-octoxy-1-oxoethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(hexylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoate Traditional Name: 4-(hexylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoic acid ethyl ester Formula: C26H44N2O4 MolecularWeight: 448.63856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(C)C1=C(C=CC(=C1)NCCCCCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCOCC(=O)N(C)C1=C(C=CC(=C1)NCCCCCC)C(=O)OCC

InChI

InChI=1S/C26H44N2O4/c1-5-8-10-12-13-15-19-31-21-25(29)28(4)24-20-22(27-18-14-11-9-6-2)16-17-23(24)26(30)32-7-3/h16-17,20,27H,5-15,18-19,21H2,1-4H3