1-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-[1-(3-nitro-2-pyridyl)-4-piperidyl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[1-(3-nitro-2-pyridinyl)-4-piperidinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[1-(3-nitropyridin-2-yl)piperidin-4-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-[1-(3-nitro-2-pyridyl)-4-piperidyl]-3-phenyl-prop-2-yn-1-one Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C#CC2=CC=CC=C2)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)C#CC2=CC=CC=C2)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O3/c23-18(9-8-15-5-2-1-3-6-15)16-10-13-21(14-11-16)19-17(22(24)25)7-4-12-20-19/h1-7,12,16H,10-11,13-14H2