methyl 2-[methyl(2-octoxyethanoyl)amino]-4-nitro-benzoate

Systemtic Name: methyl 2-[methyl(2-octoxyethanoyl)amino]-4-nitro-benzoate Openeye Name: methyl 2-[methyl-(2-octoxyacetyl)amino]-4-nitro-benzoate CAS Name: 2-[methyl-(2-octoxy-1-oxoethyl)amino]-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[methyl-(2-octoxyacetyl)amino]-4-nitrobenzoate Traditional Name: 2-[methyl-(2-octoxyacetyl)amino]-4-nitro-benzoic acid methyl ester Formula: C19H28N2O6 MolecularWeight: 380.43542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O6/c1-4-5-6-7-8-9-12-27-14-18(22)20(2)17-13-15(21(24)25)10-11-16(17)19(23)26-3/h10-11,13H,4-9,12,14H2,1-3H3