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

Systemtic Name: methyl 2-[2-ethoxyethanoyl(methyl)amino]-4-nitro-benzoate Openeye Name: methyl 2-[(2-ethoxyacetyl)-methyl-amino]-4-nitro-benzoate CAS Name: 2-[(2-ethoxy-1-oxoethyl)-methylamino]-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[(2-ethoxyacetyl)-methylamino]-4-nitrobenzoate Traditional Name: 2-[(2-ethoxyacetyl)-methyl-amino]-4-nitro-benzoic acid methyl ester Formula: C13H16N2O6 MolecularWeight: 296.27594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6/c1-4-21-8-12(16)14(2)11-7-9(15(18)19)5-6-10(11)13(17)20-3/h5-7H,4,8H2,1-3H3