(2-fluorophenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate

Systemtic Name: (2-fluorophenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: (2-fluorophenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid (2-fluorobenzyl) ester Formula: C18H17FN2O4 MolecularWeight: 344.336983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN2O4/c19-15-6-2-1-5-14(15)12-25-18(22)13-7-8-16(17(11-13)21(23)24)20-9-3-4-10-20/h1-2,5-8,11H,3-4,9-10,12H2