ethyl 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyethanoyl)amino]benzoate

Systemtic Name: ethyl 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyethanoyl)amino]benzoate Openeye Name: ethyl 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoate CAS Name: 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxy-1-oxoethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoate Traditional Name: 4-benzamido-2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-octoxyacetyl)amino]benzoic acid ethyl ester Formula: C36H50N2O5 MolecularWeight: 590.7926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(CC=C(C)CCC=C(C)C)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCCCOCC(=O)N(C/C=C(/C)\CCC=C(C)C)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C36H50N2O5/c1-6-8-9-10-11-15-25-42-27-34(39)38(24-23-29(5)18-16-17-28(3)4)33-26-31(21-22-32(33)36(41)43-7-2)37-35(40)30-19-13-12-14-20-30/h12-14,17,19-23,26H,6-11,15-16,18,24-25,27H2,1-5H3,(H,37,40)/b29-23-