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

Systemtic Name: ethyl 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-ethoxyethanoyl)amino]-4-nitro-benzoate Openeye Name: ethyl 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-ethoxyacetyl)amino]-4-nitro-benzoate CAS Name: 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-ethoxy-1-oxoethyl)amino]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-ethoxyacetyl)amino]-4-nitrobenzoate Traditional Name: 2-[[(2Z)-3,7-dimethylocta-2,6-dienyl]-(2-ethoxyacetyl)amino]-4-nitro-benzoic acid ethyl ester Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)N(CC=C(C)CCC=C(C)C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOCC(=O)N(C/C=C(/C)\CCC=C(C)C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C23H32N2O6/c1-6-30-16-22(26)24(14-13-18(5)10-8-9-17(3)4)21-15-19(25(28)29)11-12-20(21)23(27)31-7-2/h9,11-13,15H,6-8,10,14,16H2,1-5H3/b18-13-