(2-chloranyl-6-fluoranyl-phenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C19H18ClFN2O4 MolecularWeight: 392.808623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClFN2O4/c20-15-5-4-6-16(21)14(15)12-27-19(24)13-7-8-17(18(11-13)23(25)26)22-9-2-1-3-10-22/h4-8,11H,1-3,9-10,12H2