[2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methoxy-3-nitro-benzoate

Systemtic Name: [2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methoxy-3-nitro-benzoate Openeye Name: [2-(2-methoxyethylcarbamoylamino)-2-oxo-ethyl] 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid [2-[[(2-methoxyethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylcarbamoylamino)-2-oxoethyl] 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid [2-keto-2-(2-methoxyethylcarbamoylamino)ethyl] ester Formula: C14H17N3O8 MolecularWeight: 355.30008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O8/c1-23-6-5-15-14(20)16-12(18)8-25-13(19)9-3-4-11(24-2)10(7-9)17(21)22/h3-4,7H,5-6,8H2,1-2H3,(H2,15,16,18,20)