N-(5-nitropyridin-3-yl)sulfonyloctanamide

Systemtic Name: N-(5-nitropyridin-3-yl)sulfonyloctanamide Openeye Name: N-[(5-nitro-3-pyridyl)sulfonyl]octanamide CAS Name: N-[(5-nitro-3-pyridinyl)sulfonyl]octanamide IUPAC Name: N-(5-nitropyridin-3-yl)sulfonyloctanamide Traditional Name: N-[(5-nitro-3-pyridyl)sulfonyl]caprylamide Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NS(=O)(=O)C1=CN=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC(=O)NS(=O)(=O)C1=CN=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5S/c1-2-3-4-5-6-7-13(17)15-22(20,21)12-8-11(16(18)19)9-14-10-12/h8-10H,2-7H2,1H3,(H,15,17)