methyl 2-[(2,6-dimethyl-3-nitro-phenyl)-(2-ethoxyethanoyl)amino]propanoate

Systemtic Name: methyl 2-[(2,6-dimethyl-3-nitro-phenyl)-(2-ethoxyethanoyl)amino]propanoate Openeye Name: methyl 2-(N-(2-ethoxyacetyl)-2,6-dimethyl-3-nitro-anilino)propanoate CAS Name: 2-(N-(2-ethoxy-1-oxoethyl)-2,6-dimethyl-3-nitroanilino)propanoic acid methyl ester IUPAC Name: methyl 2-(N-(2-ethoxyacetyl)-2,6-dimethyl-3-nitroanilino)propanoate Traditional Name: 2-(N-(2-ethoxyacetyl)-2,6-dimethyl-3-nitro-anilino)propionic acid methyl ester Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)N(C1=C(C=CC(=C1C)[N+](=O)[O-])C)C(C)C(=O)OC

Isomeric SMILES

CCOCC(=O)N(C1=C(C=CC(=C1C)[N+](=O)[O-])C)C(C)C(=O)OC

InChI

InChI=1S/C16H22N2O6/c1-6-24-9-14(19)17(12(4)16(20)23-5)15-10(2)7-8-13(11(15)3)18(21)22/h7-8,12H,6,9H2,1-5H3