1-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]butan-1-one CAS Name: 1-[4-[4-fluoro-2-nitro-5-(1-pyrrolidinyl)phenyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-ylphenyl)piperazin-1-yl]butan-1-one Traditional Name: 1-[4-(4-fluoro-2-nitro-5-pyrrolidino-phenyl)piperazino]butan-1-one Formula: C18H25FN4O3 MolecularWeight: 364.414503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCC3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCC3

InChI

InChI=1S/C18H25FN4O3/c1-2-5-18(24)22-10-8-21(9-11-22)16-13-15(20-6-3-4-7-20)14(19)12-17(16)23(25)26/h12-13H,2-11H2,1H3