[4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: [4-[(3-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-(5-nitro-2-furyl)methanone CAS Name: [4-[(3-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: [4-(3-chloro-4-fluoro-benzyl)piperazino]-(5-nitro-2-furyl)methanone Formula: C16H15ClFN3O4 MolecularWeight: 367.759403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)F)Cl)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)F)Cl)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClFN3O4/c17-12-9-11(1-2-13(12)18)10-19-5-7-20(8-6-19)16(22)14-3-4-15(25-14)21(23)24/h1-4,9H,5-8,10H2