cyanomethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: cyanomethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: cyanomethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid cyanomethyl ester Formula: C11H11N3O5 MolecularWeight: 265.22214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O5/c12-3-6-19-11(16)9-7-8(14(17)18)1-2-10(9)13-4-5-15/h1-2,7,13,15H,4-6H2