(4-bromophenyl) 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (4-bromophenyl) 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (4-bromophenyl) 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-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)C(=O)OC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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