(2-azanyl-2-oxidanylidene-ethyl) 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(dimethylamino)-3-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)OCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c1-13(2)8-4-3-7(5-9(8)14(17)18)11(16)19-6-10(12)15/h3-5H,6H2,1-2H3,(H2,12,15)