[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 2-azanyl-4-nitro-benzoate

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 2-azanyl-4-nitro-benzoate Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl] 2-amino-4-nitro-benzoate CAS Name: 2-amino-4-nitrobenzoic acid [2-(2-methoxyethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl] 2-amino-4-nitrobenzoate Traditional Name: 2-amino-4-nitro-benzoic acid [2-keto-2-(2-methoxyethylamino)ethyl] ester Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

COCCNC(=O)COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C12H15N3O6/c1-20-5-4-14-11(16)7-21-12(17)9-3-2-8(15(18)19)6-10(9)13/h2-3,6H,4-5,7,13H2,1H3,(H,14,16)