(4-bromophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (4-bromophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (4-bromophenyl)methyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (4-bromobenzyl) ester Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN2O4/c20-16-7-4-14(5-8-16)13-26-19(23)15-6-9-17(18(12-15)22(24)25)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11,13H2