5-[1-(3-nitropyridin-2-yl)piperidin-4-ylidene]pent-3-yn-2-one

Systemtic Name: 5-[1-(3-nitropyridin-2-yl)piperidin-4-ylidene]pent-3-yn-2-one Openeye Name: 5-[1-(3-nitro-2-pyridyl)-4-piperidylidene]pent-3-yn-2-one CAS Name: 5-[1-(3-nitro-2-pyridinyl)-4-piperidinylidene]-3-pentyn-2-one IUPAC Name: 5-[1-(3-nitropyridin-2-yl)piperidin-4-ylidene]pent-3-yn-2-one Traditional Name: 5-[1-(3-nitro-2-pyridyl)-4-piperidylidene]pent-3-yn-2-one Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C#CC=C1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C#CC=C1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O3/c1-12(19)4-2-5-13-7-10-17(11-8-13)15-14(18(20)21)6-3-9-16-15/h3,5-6,9H,7-8,10-11H2,1H3