2-(3-bromanylphenoxy)ethyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: 2-(3-bromophenoxy)ethyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C19H19BrN2O6 MolecularWeight: 451.26796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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