1-[4-(2-fluorophenyl)but-1-en-3-yn-2-yl]-4-(3-nitropyridin-2-yl)piperazine

Systemtic Name: 1-[4-(2-fluorophenyl)but-1-en-3-yn-2-yl]-4-(3-nitropyridin-2-yl)piperazine Openeye Name: 1-[3-(2-fluorophenyl)-1-methylene-prop-2-ynyl]-4-(3-nitro-2-pyridyl)piperazine CAS Name: 1-[4-(2-fluorophenyl)but-1-en-3-yn-2-yl]-4-(3-nitro-2-pyridinyl)piperazine IUPAC Name: 1-[4-(2-fluorophenyl)but-1-en-3-yn-2-yl]-4-(3-nitropyridin-2-yl)piperazine Traditional Name: 1-[3-(2-fluorophenyl)-1-methylene-prop-2-ynyl]-4-(3-nitro-2-pyridyl)piperazine Formula: C19H17FN4O2 MolecularWeight: 352.362283

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C#CC1=CC=CC=C1F)N2CCN(CC2)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C=C(C#CC1=CC=CC=C1F)N2CCN(CC2)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H17FN4O2/c1-15(8-9-16-5-2-3-6-17(16)20)22-11-13-23(14-12-22)19-18(24(25)26)7-4-10-21-19/h2-7,10H,1,11-14H2