2-(4-bromanylphenoxy)ethyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: 2-(4-bromophenoxy)ethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid 2-(4-bromophenoxy)ethyl ester Formula: C19H19BrN2O6 MolecularWeight: 451.26796

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN2O6/c20-15-2-4-16(5-3-15)27-11-12-28-19(23)14-1-6-17(18(13-14)22(24)25)21-7-9-26-10-8-21/h1-6,13H,7-12H2