N-(4,6-dimethyl-3-nitro-pyridin-2-yl)pentanamide

Systemtic Name: N-(4,6-dimethyl-3-nitro-pyridin-2-yl)pentanamide Openeye Name: N-(4,6-dimethyl-3-nitro-2-pyridyl)pentanamide CAS Name: N-(4,6-dimethyl-3-nitro-2-pyridinyl)pentanamide IUPAC Name: N-(4,6-dimethyl-3-nitropyridin-2-yl)pentanamide Traditional Name: N-(4,6-dimethyl-3-nitro-2-pyridyl)valeramide Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CC(=N1)C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CC(=N1)C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-4-5-6-10(16)14-12-11(15(17)18)8(2)7-9(3)13-12/h7H,4-6H2,1-3H3,(H,13,14,16)