ethyl 4-(hex-5-enylamino)-2-[2-octoxyethanoyl(propyl)amino]benzoate

Systemtic Name: ethyl 4-(hex-5-enylamino)-2-[2-octoxyethanoyl(propyl)amino]benzoate Openeye Name: ethyl 4-(hex-5-enylamino)-2-[(2-octoxyacetyl)-propyl-amino]benzoate CAS Name: 4-(hex-5-enylamino)-2-[(2-octoxy-1-oxoethyl)-propylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(hex-5-enylamino)-2-[(2-octoxyacetyl)-propylamino]benzoate Traditional Name: 4-(hex-5-enylamino)-2-[(2-octoxyacetyl)-propyl-amino]benzoic acid ethyl ester Formula: C28H46N2O4 MolecularWeight: 474.67584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(CCC)C1=C(C=CC(=C1)NCCCCC=C)C(=O)OCC

Isomeric SMILES

CCCCCCCCOCC(=O)N(CCC)C1=C(C=CC(=C1)NCCCCC=C)C(=O)OCC

InChI

InChI=1S/C28H46N2O4/c1-5-9-11-13-14-16-21-33-23-27(31)30(20-7-3)26-22-24(29-19-15-12-10-6-2)17-18-25(26)28(32)34-8-4/h6,17-18,22,29H,2,5,7-16,19-21,23H2,1,3-4H3