1-hept-1-en-3-yn-2-yl-4-(3-nitropyridin-2-yl)piperazine

Systemtic Name: 1-hept-1-en-3-yn-2-yl-4-(3-nitropyridin-2-yl)piperazine Openeye Name: 1-(1-methylenehex-2-ynyl)-4-(3-nitro-2-pyridyl)piperazine CAS Name: 1-hept-1-en-3-yn-2-yl-4-(3-nitro-2-pyridinyl)piperazine IUPAC Name: 1-hept-1-en-3-yn-2-yl-4-(3-nitropyridin-2-yl)piperazine Traditional Name: 1-(1-methylenehex-2-ynyl)-4-(3-nitro-2-pyridyl)piperazine Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(=C)N1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CCCC#CC(=C)N1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O2/c1-3-4-5-7-14(2)18-10-12-19(13-11-18)16-15(20(21)22)8-6-9-17-16/h6,8-9H,2-4,10-13H2,1H3