(4-bromophenyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (4-bromophenyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (4-bromophenyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (4-bromophenyl) ester Formula: C17H15BrN2O5 MolecularWeight: 407.2154

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC3=CC=C(C=C3)Br

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN2O5/c18-12-1-4-14(5-2-12)25-17(21)15-11-13(20(22)23)3-6-16(15)19-7-9-24-10-8-19/h1-6,11H,7-10H2