1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-4-[(5-nitrothiophen-3-yl)methyl]piperazine

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-4-[(5-nitrothiophen-3-yl)methyl]piperazine Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-4-[(5-nitro-3-thienyl)methyl]piperazine CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-4-[(5-nitro-3-thiophenyl)methyl]piperazine IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-4-[(5-nitrothiophen-3-yl)methyl]piperazine Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-4-[(5-nitro-3-thienyl)methyl]piperazine Formula: C16H17ClFN3O2S MolecularWeight: 369.841483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)CC3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)CC3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClFN3O2S/c17-15-8-14(18)2-1-13(15)10-20-5-3-19(4-6-20)9-12-7-16(21(22)23)24-11-12/h1-2,7-8,11H,3-6,9-10H2