(2-azanyl-2-oxidanylidene-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C11H13N3O6 MolecularWeight: 283.23742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O6/c12-10(16)6-20-11(17)8-5-7(14(18)19)1-2-9(8)13-3-4-15/h1-2,5,13,15H,3-4,6H2,(H2,12,16)