1-hexyl-3-nitro-5-pyridin-4-yl-pyridin-2-one

Systemtic Name: 1-hexyl-3-nitro-5-pyridin-4-yl-pyridin-2-one Openeye Name: 1-hexyl-3-nitro-5-(4-pyridyl)pyridin-2-one CAS Name: 1-hexyl-3-nitro-5-pyridin-4-yl-2-pyridinone IUPAC Name: 1-hexyl-3-nitro-5-pyridin-4-ylpyridin-2-one Traditional Name: 1-hexyl-3-nitro-5-(4-pyridyl)-2-pyridone Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C=C(C1=O)[N+](=O)[O-])C2=CC=NC=C2

Isomeric SMILES

CCCCCCN1C=C(C=C(C1=O)[N+](=O)[O-])C2=CC=NC=C2

InChI

InChI=1S/C16H19N3O3/c1-2-3-4-5-10-18-12-14(13-6-8-17-9-7-13)11-15(16(18)20)19(21)22/h6-9,11-12H,2-5,10H2,1H3