[2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-13(2,3)14-11(16)8-20-12(17)9-5-4-6-10(7-9)15(18)19/h4-7H,8H2,1-3H3,(H,14,16)