1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[4-[2-(3-nitrophenoxy)ethyl]piperazino]butan-1-one Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)CCOC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)CCOC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26FN3O4/c23-19-8-6-18(7-9-19)22(27)5-2-10-24-11-13-25(14-12-24)15-16-30-21-4-1-3-20(17-21)26(28)29/h1,3-4,6-9,17H,2,5,10-16H2