[2-octoxyethanoyl(prop-2-enyl)amino] 4-butoxy-2-ethyl-benzoate

Systemtic Name: [2-octoxyethanoyl(prop-2-enyl)amino] 4-butoxy-2-ethyl-benzoate Openeye Name: [allyl-(2-octoxyacetyl)amino] 4-butoxy-2-ethyl-benzoate CAS Name: 4-butoxy-2-ethylbenzoic acid [(2-octoxy-1-oxoethyl)-prop-2-enylamino] ester IUPAC Name: [(2-octoxyacetyl)-prop-2-enylamino] 4-butoxy-2-ethylbenzoate Traditional Name: 4-butoxy-2-ethyl-benzoic acid [allyl-(2-octoxyacetyl)amino] ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(CC=C)OC(=O)C1=C(C=C(C=C1)OCCCC)CC

Isomeric SMILES

CCCCCCCCOCC(=O)N(CC=C)OC(=O)C1=C(C=C(C=C1)OCCCC)CC

InChI

InChI=1S/C26H41NO5/c1-5-9-11-12-13-14-18-30-21-25(28)27(17-7-3)32-26(29)24-16-15-23(20-22(24)8-4)31-19-10-6-2/h7,15-16,20H,3,5-6,8-14,17-19,21H2,1-2,4H3