ethyl 2-[methyl(2-octoxyethanoyl)amino]-3-nitro-benzoate

Systemtic Name: ethyl 2-[methyl(2-octoxyethanoyl)amino]-3-nitro-benzoate Openeye Name: ethyl 2-[methyl-(2-octoxyacetyl)amino]-3-nitro-benzoate CAS Name: 2-[methyl-(2-octoxy-1-oxoethyl)amino]-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[methyl-(2-octoxyacetyl)amino]-3-nitrobenzoate Traditional Name: 2-[methyl-(2-octoxyacetyl)amino]-3-nitro-benzoic acid ethyl ester Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O6/c1-4-6-7-8-9-10-14-27-15-18(23)21(3)19-16(20(24)28-5-2)12-11-13-17(19)22(25)26/h11-13H,4-10,14-15H2,1-3H3