1-[3-fluoranyl-4-[4-[1-(3-nitrophenyl)ethyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-[1-(3-nitrophenyl)ethyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-[1-(3-nitrophenyl)ethyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[1-(3-nitrophenyl)ethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-[1-(3-nitrophenyl)ethyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-[1-(3-nitrophenyl)ethyl]piperazino]phenyl]ethanone Formula: C20H22FN3O3 MolecularWeight: 371.405383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

InChI

InChI=1S/C20H22FN3O3/c1-14(16-4-3-5-18(12-16)24(26)27)22-8-10-23(11-9-22)20-7-6-17(15(2)25)13-19(20)21/h3-7,12-14H,8-11H2,1-2H3