2-(4-cyanophenoxy)ethyl 2-(methylamino)-5-nitro-benzoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 2-(methylamino)-5-nitro-benzoate Openeye Name: 2-(4-cyanophenoxy)ethyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid 2-(4-cyanophenoxy)ethyl ester Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H15N3O5/c1-19-16-7-4-13(20(22)23)10-15(16)17(21)25-9-8-24-14-5-2-12(11-18)3-6-14/h2-7,10,19H,8-9H2,1H3