2-(4-bromanylphenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: 2-(4-bromophenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid 2-(4-bromophenoxy)ethyl ester Formula: C19H19BrN2O5 MolecularWeight: 435.26856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN2O5/c20-15-4-6-16(7-5-15)26-11-12-27-19(23)14-3-8-17(18(13-14)22(24)25)21-9-1-2-10-21/h3-8,13H,1-2,9-12H2