[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C12H13N3O6 MolecularWeight: 295.24812

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O6/c1-2-13-12(18)14-10(16)7-21-11(17)8-4-3-5-9(6-8)15(19)20/h3-6H,2,7H2,1H3,(H2,13,14,16,18)